N-[(E)-[1-(4-chlorophenyl)ethylidene]amino]-1-{[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}methanimidamide

N-[(E)-[1-(4-chlorophenyl)ethylidene]amino]-1-{[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}methanimidamide

Formula: C19H16ClFN4O2S

SMILES: CC(=N/NC(=N)SC1CC(=O)N(C1=O)C1=CC=C(F)C=C1)C1=CC=C(Cl)C=C1

IUPAC: N-[(E)-[1-(4-chlorophenyl)ethylidene]amino]-1-{[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}methanimidamide

InChI: InChI=1/C19H16ClFN4O2S/c1-11(12-2-4-13(20)5-3-12)23-24-19(22)28-16-10-17(26)25(18(16)27)15-8-6-14(21)7-9-15/h2-9,16H,10H2,1H3,(H2,22,24)/b23-11+

Composition: C (54.48%), H (3.85%), Cl (8.46%), F (4.54%), N (13.38%), O (7.64%), S (7.65%)

Molar Mass: 418.87

Atom Count: 44

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	418.0666528
Formal Charge	0
FSP3	0.16
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	NNYHHEPKJJVAOL-FOKLQQMPNA-N
Lipinski's Rule of Five	1
Molar Refractivity	127.59
Topological Polar Surface Area	85.62
Polarizability	40.62
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H16ClFN4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00