1-(2-chloranyl-5-nitro-phenyl)-3-[2-(phenylmethyl)phenyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[2-(phenylmethyl)phenyl]thiourea Openeye Name: 1-(2-benzylphenyl)-3-(2-chloro-5-nitro-phenyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[2-(phenylmethyl)phenyl]thiourea IUPAC Name: 1-(2-benzylphenyl)-3-(2-chloro-5-nitrophenyl)thiourea Traditional Name: 1-(2-benzylphenyl)-3-(2-chloro-5-nitro-phenyl)thiourea Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H16ClN3O2S/c21-17-11-10-16(24(25)26)13-19(17)23-20(27)22-18-9-5-4-8-15(18)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H2,22,23,27)