N,N-bis(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N,N-bis(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N,N-bis(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N,N-bis(2-cyanoethyl)-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N,N-bis(2-cyanoethyl)-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C17H17N5OS/c1-13-20-15-7-3-2-6-14(15)17(21-13)24-12-16(23)22(10-4-8-18)11-5-9-19/h2-3,6-7H,4-5,10-12H2,1H3