2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-[(2-chlorophenyl)methyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxamide

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-[(2-chlorophenyl)methyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxamide Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-[(2-chlorophenyl)methyl]-4-oxo-3-phenethyl-quinazoline-7-carboxamide CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-N-[(2-chlorophenyl)methyl]-4-oxo-3-phenethyl-7-quinazolinecarboxamide IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-[(2-chlorophenyl)methyl]-4-oxo-3-phenethylquinazoline-7-carboxamide Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-N-(2-chlorobenzyl)-4-keto-3-phenethyl-quinazoline-7-carboxamide Formula: C32H26ClN5O2S MolecularWeight: 580.09914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=C4Cl)N=C2SCC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=C4Cl)N=C2SCC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C32H26ClN5O2S/c33-25-11-5-4-10-23(25)19-34-30(39)22-14-15-24-28(18-22)37-32(38(31(24)40)17-16-21-8-2-1-3-9-21)41-20-29-35-26-12-6-7-13-27(26)36-29/h1-15,18H,16-17,19-20H2,(H,34,39)(H,35,36)