N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxidanylidene-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide

Systemtic Name: N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxidanylidene-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide Openeye Name: N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide CAS Name: N-butyl-3-[5-(cyanomethylthio)-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide IUPAC Name: N-butyl-3-[5-(cyanomethylsulfanyl)-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide Traditional Name: N-butyl-3-[5-(cyanomethylthio)-3-keto-2H-imidazo[1,2-c]quinazolin-2-yl]propionamide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCC1C(=O)N2C(=N1)C3=CC=CC=C3N=C2SCC#N

Isomeric SMILES

CCCCNC(=O)CCC1C(=O)N2C(=N1)C3=CC=CC=C3N=C2SCC#N

InChI

InChI=1S/C19H21N5O2S/c1-2-3-11-21-16(25)9-8-15-18(26)24-17(22-15)13-6-4-5-7-14(13)23-19(24)27-12-10-20/h4-7,15H,2-3,8-9,11-12H2,1H3,(H,21,25)