4-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-3-oxo-N-phenyl-butanamide CAS Name: 4-[(4-amino-5-cyano-2-pyrimidinyl)thio]-3-oxo-N-phenylbutanamide IUPAC Name: 4-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-3-oxo-N-phenylbutanamide Traditional Name: 4-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-3-keto-N-phenyl-butyramide Formula: C15H13N5O2S MolecularWeight: 327.36102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CC(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CC(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C15H13N5O2S/c16-7-10-8-18-15(20-14(10)17)23-9-12(21)6-13(22)19-11-4-2-1-3-5-11/h1-5,8H,6,9H2,(H,19,22)(H2,17,18,20)