4-[(2-aminophenyl)amino]-2-oxidanylidene-1-(thiophen-2-ylmethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-[(2-aminophenyl)amino]-2-oxidanylidene-1-(thiophen-2-ylmethyl)pyrimidine-5-carbonitrile Openeye Name: 4-(2-aminoanilino)-2-oxo-1-(2-thienylmethyl)pyrimidine-5-carbonitrile CAS Name: 4-(2-aminoanilino)-2-oxo-1-(thiophen-2-ylmethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-(2-aminoanilino)-2-oxo-1-(thiophen-2-ylmethyl)pyrimidine-5-carbonitrile Traditional Name: 4-(2-aminoanilino)-2-keto-1-(2-thenyl)pyrimidine-5-carbonitrile Formula: C16H13N5OS MolecularWeight: 323.37232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC2=NC(=O)N(C=C2C#N)CC3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)N)NC2=NC(=O)N(C=C2C#N)CC3=CC=CS3

InChI

InChI=1S/C16H13N5OS/c17-8-11-9-21(10-12-4-3-7-23-12)16(22)20-15(11)19-14-6-2-1-5-13(14)18/h1-7,9H,10,18H2,(H,19,20,22)