N-[(1R,2S)-2-methylcyclohexyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(1R,2S)-2-methylcyclohexyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[(1R,2S)-2-methylcyclohexyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(1R,2S)-2-methylcyclohexyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(1R,2S)-2-methylcyclohexyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[(1R,2S)-2-methylcyclohexyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C19H23N3O2S/c1-3-10-22-18(24)14-9-8-13(11-16(14)21-19(22)25)17(23)20-15-7-5-4-6-12(15)2/h3,8-9,11-12,15H,1,4-7,10H2,2H3,(H,20,23)(H,21,25)/t12-,15+/m0/s1