N-(4-naphthalen-1-yl-1,3-thiazol-2-yl)-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide

Systemtic Name: N-(4-naphthalen-1-yl-1,3-thiazol-2-yl)-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Openeye Name: N-[4-(1-naphthyl)thiazol-2-yl]-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide CAS Name: N-[4-(1-naphthalenyl)-2-thiazolyl]-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide IUPAC Name: N-(4-naphthalen-1-yl-1,3-thiazol-2-yl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Traditional Name: 12-keto-N-[4-(1-naphthyl)thiazol-2-yl]-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Formula: C27H22N4O2S MolecularWeight: 466.55418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(C=CC(=C3)C(=O)NC4=NC(=CS4)C5=CC=CC6=CC=CC=C65)C(=O)N2CC1

Isomeric SMILES

C1CCC2=NC3=C(C=CC(=C3)C(=O)NC4=NC(=CS4)C5=CC=CC6=CC=CC=C65)C(=O)N2CC1

InChI

InChI=1S/C27H22N4O2S/c32-25(18-12-13-21-22(15-18)28-24-11-2-1-5-14-31(24)26(21)33)30-27-29-23(16-34-27)20-10-6-8-17-7-3-4-9-19(17)20/h3-4,6-10,12-13,15-16H,1-2,5,11,14H2,(H,29,30,32)