N-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-indan-5-yl-4-oxo-3-phenethyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-4-oxo-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-4-oxo-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-indan-5-yl-4-keto-3-phenethyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCC5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O2S/c30-24(27-21-11-9-18-7-4-8-19(18)15-21)20-10-12-22-23(16-20)28-26(32)29(25(22)31)14-13-17-5-2-1-3-6-17/h1-3,5-6,9-12,15-16H,4,7-8,13-14H2,(H,27,30)(H,28,32)