1-(4-chlorophenyl)-2-[4-[(phenylmethyl)amino]quinazolin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-[(phenylmethyl)amino]quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 2-[4-(benzylamino)quinazolin-2-yl]sulfanyl-1-(4-chlorophenyl)ethanone CAS Name: 1-(4-chlorophenyl)-2-[[4-[(phenylmethyl)amino]-2-quinazolinyl]thio]ethanone IUPAC Name: 2-[4-(benzylamino)quinazolin-2-yl]sulfanyl-1-(4-chlorophenyl)ethanone Traditional Name: 2-[[4-(benzylamino)quinazolin-2-yl]thio]-1-(4-chlorophenyl)ethanone Formula: C23H18ClN3OS MolecularWeight: 419.92652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)SCC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C32)SCC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3OS/c24-18-12-10-17(11-13-18)21(28)15-29-23-26-20-9-5-4-8-19(20)22(27-23)25-14-16-6-2-1-3-7-16/h1-13H,14-15H2,(H,25,26,27)