1-[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)-oxidanyl-methyl]quinazolin-2-yl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)-oxidanyl-methyl]quinazolin-2-yl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]quinazolin-2-yl]thiourea CAS Name: 1-[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methyl-4-imidazolyl)methyl]-2-quinazolinyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]quinazolin-2-yl]thiourea Traditional Name: 1-benzyl-3-[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]quinazolin-2-yl]thiourea Formula: C33H26Cl2N6OS MolecularWeight: 625.57014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)Cl)(C3=CC4=C(C=C3)N=C(N=C4C5=CC(=CC=C5)Cl)NC(=S)NCC6=CC=CC=C6)O

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)Cl)(C3=CC4=C(C=C3)N=C(N=C4C5=CC(=CC=C5)Cl)NC(=S)NCC6=CC=CC=C6)O

InChI

InChI=1S/C33H26Cl2N6OS/c1-41-20-36-19-29(41)33(42,23-10-13-25(34)14-11-23)24-12-15-28-27(17-24)30(22-8-5-9-26(35)16-22)39-31(38-28)40-32(43)37-18-21-6-3-2-4-7-21/h2-17,19-20,42H,18H2,1H3,(H2,37,38,39,40,43)