N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[4-(1,1-dimethylpropyl)cyclohexyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-(4-tert-amylcyclohexyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H31N3O2S MolecularWeight: 413.57614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C23H31N3O2S/c1-5-13-26-21(28)18-12-7-15(14-19(18)25-22(26)29)20(27)24-17-10-8-16(9-11-17)23(3,4)6-2/h5,7,12,14,16-17H,1,6,8-11,13H2,2-4H3,(H,24,27)(H,25,29)