7-[4-(2-phenoxyethyl)piperazin-1-yl]carbonyl-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-[4-(2-phenoxyethyl)piperazin-1-yl]carbonyl-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(2-phenoxyethyl)piperazine-1-carbonyl]-3-phenyl-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[oxo-[4-(2-phenoxyethyl)-1-piperazinyl]methyl]-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(2-phenoxyethyl)piperazine-1-carbonyl]-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(2-phenoxyethyl)piperazine-1-carbonyl]-3-phenyl-2-thioxo-1H-quinazolin-4-one Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3S/c32-25(30-15-13-29(14-16-30)17-18-34-22-9-5-2-6-10-22)20-11-12-23-24(19-20)28-27(35)31(26(23)33)21-7-3-1-4-8-21/h1-12,19H,13-18H2,(H,28,35)