3-(5-chloranyl-2-methoxy-phenyl)-1,1-bis(phenylmethyl)thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1,1-bis(phenylmethyl)thiourea Openeye Name: 1,1-dibenzyl-3-(5-chloro-2-methoxy-phenyl)thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1,1-bis(phenylmethyl)thiourea IUPAC Name: 1,1-dibenzyl-3-(5-chloro-2-methoxyphenyl)thiourea Traditional Name: 1,1-dibenzyl-3-(5-chloro-2-methoxy-phenyl)thiourea Formula: C22H21ClN2OS MolecularWeight: 396.93294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H21ClN2OS/c1-26-21-13-12-19(23)14-20(21)24-22(27)25(15-17-8-4-2-5-9-17)16-18-10-6-3-7-11-18/h2-14H,15-16H2,1H3,(H,24,27)