N-[(2-chlorophenyl)methyl]-2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-3-phenethyl-quinazoline-7-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[(3-chlorophenyl)methylthio]-4-oxo-3-phenethyl-7-quinazolinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-3-phenethylquinazoline-7-carboxamide Traditional Name: N-(2-chlorobenzyl)-2-[(3-chlorobenzyl)thio]-4-keto-3-phenethyl-quinazoline-7-carboxamide Formula: C31H25Cl2N3O2S MolecularWeight: 574.5201

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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=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=C4Cl)N=C2SCC5=CC(=CC=C5)Cl

InChI

InChI=1S/C31H25Cl2N3O2S/c32-25-11-6-9-22(17-25)20-39-31-35-28-18-23(29(37)34-19-24-10-4-5-12-27(24)33)13-14-26(28)30(38)36(31)16-15-21-7-2-1-3-8-21/h1-14,17-18H,15-16,19-20H2,(H,34,37)