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

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-benzyl-N-indan-5-yl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-4-oxo-3-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-benzyl-N-(2,3-dihydro-1H-inden-5-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-benzyl-N-indan-5-yl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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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)CC5=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)CC5=CC=CC=C5

InChI

InChI=1S/C25H21N3O2S/c29-23(26-20-11-9-17-7-4-8-18(17)13-20)19-10-12-21-22(14-19)27-25(31)28(24(21)30)15-16-5-2-1-3-6-16/h1-3,5-6,9-14H,4,7-8,15H2,(H,26,29)(H,27,31)