(5E)-5-{[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

(5E)-5-{[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C18H20N2O4S

SMILES: CCOC1=CC(C=C2/C(=O)NC(=S)N(C)C2=O)=CC(CC=C)=C1OC

IUPAC: (5E)-5-{[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C18H20N2O4S/c1-5-7-12-8-11(10-14(24-6-2)15(12)23-4)9-13-16(21)19-18(25)20(3)17(13)22/h5,8-10H,1,6-7H2,2-4H3,(H,19,21,25)/b13-9+

Composition: C (59.98%), H (5.59%), N (7.77%), O (17.76%), S (8.89%)

Molar Mass: 360.43

Atom Count: 45

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	360.114378306
Formal Charge	0
FSP3	0.28
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	IADSRYWPLSYNEL-UKTHLTGXSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.97
Topological Polar Surface Area	67.87
Polarizability	38.42
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00