4-oxidanylidene-N-pentyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-pentyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-4-oxo-N-pentyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-pentyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-pentyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-amyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

Isomeric SMILES

CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

InChI

InChI=1S/C17H21N3O2S/c1-3-5-6-9-18-15(21)12-7-8-13-14(11-12)19-17(23)20(10-4-2)16(13)22/h4,7-8,11H,2-3,5-6,9-10H2,1H3,(H,18,21)(H,19,23)