N-(1-naphthalen-1-ylethyl)-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(1-naphthalen-1-ylethyl)-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[1-(1-naphthyl)ethyl]-4-oxo-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[1-(1-naphthalenyl)ethyl]-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(1-naphthalen-1-ylethyl)-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-[1-(1-naphthyl)ethyl]-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C27H21N3O2S MolecularWeight: 451.53954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC=CC=C5

InChI

InChI=1S/C27H21N3O2S/c1-17(21-13-7-9-18-8-5-6-12-22(18)21)28-25(31)19-14-15-23-24(16-19)29-27(33)30(26(23)32)20-10-3-2-4-11-20/h2-17H,1H3,(H,28,31)(H,29,33)