2-(cyanomethylsulfanyl)-3-(2-methoxyethyl)-4-oxidanylidene-N-propyl-quinazoline-7-carboxamide

Systemtic Name: 2-(cyanomethylsulfanyl)-3-(2-methoxyethyl)-4-oxidanylidene-N-propyl-quinazoline-7-carboxamide Openeye Name: 2-(cyanomethylsulfanyl)-3-(2-methoxyethyl)-4-oxo-N-propyl-quinazoline-7-carboxamide CAS Name: 2-(cyanomethylthio)-3-(2-methoxyethyl)-4-oxo-N-propyl-7-quinazolinecarboxamide IUPAC Name: 2-(cyanomethylsulfanyl)-3-(2-methoxyethyl)-4-oxo-N-propylquinazoline-7-carboxamide Traditional Name: 2-(cyanomethylthio)-4-keto-3-(2-methoxyethyl)-N-propyl-quinazoline-7-carboxamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC#N)CCOC

Isomeric SMILES

CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC#N)CCOC

InChI

InChI=1S/C17H20N4O3S/c1-3-7-19-15(22)12-4-5-13-14(11-12)20-17(25-10-6-18)21(16(13)23)8-9-24-2/h4-5,11H,3,7-10H2,1-2H3,(H,19,22)