N-butyl-4-oxidanylidene-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-butyl-4-oxidanylidene-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-butyl-4-oxo-3-propyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-butyl-4-oxo-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-butyl-4-oxo-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-butyl-4-keto-3-propyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCC

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCC

InChI

InChI=1S/C16H21N3O2S/c1-3-5-8-17-14(20)11-6-7-12-13(10-11)18-16(22)19(9-4-2)15(12)21/h6-7,10H,3-5,8-9H2,1-2H3,(H,17,20)(H,18,22)