2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[(4-methoxyphenyl)carbamoyl]ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[(4-methoxyphenyl)carbamoyl]ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-[(4-methoxyphenyl)carbamoyl]acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-[(4-methoxyanilino)-oxomethyl]acetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-[(4-methoxyphenyl)carbamoyl]acetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-[(4-methoxyphenyl)carbamoyl]acetamide Formula: C15H14N6O3S MolecularWeight: 358.37506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C15H14N6O3S/c1-24-11-4-2-10(3-5-11)19-14(23)20-12(22)8-25-15-18-7-9(6-16)13(17)21-15/h2-5,7H,8H2,1H3,(H2,17,18,21)(H2,19,20,22,23)