1-(3-cyanophenyl)-3-(thiophene-2-carbonyl)thiourea

1-(3-cyanophenyl)-3-(thiophene-2-carbonyl)thiourea

Formula: C13H9N3OS2

SMILES: O=C(NC(=S)NC1=CC(=CC=C1)C#N)C1=CC=CS1

IUPAC: 1-(3-cyanophenyl)-3-(thiophene-2-carbonyl)thiourea

InChI: InChI=1S/C13H9N3OS2/c14-8-9-3-1-4-10(7-9)15-13(18)16-12(17)11-5-2-6-19-11/h1-7H,(H2,15,16,17,18)

Composition: C (54.34%), H (3.16%), N (14.62%), O (5.57%), S (22.31%)

Molar Mass: 287.36

Atom Count: 28

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	287.01870427
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	FLECGNNIRIUVKH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.44
Topological Polar Surface Area	64.92
Polarizability	29.67
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H9N3OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00