3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-1-(phenylmethyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(4-chloranyl-2-methoxy-5-methyl-phenyl)-1-(phenylmethyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-benzyl-3-(4-chloro-2-methoxy-5-methyl-phenyl)-1-(2-thienylmethyl)thiourea CAS Name: 3-(4-chloro-2-methoxy-5-methylphenyl)-1-(phenylmethyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4-chloro-2-methoxy-5-methylphenyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-benzyl-3-(4-chloro-2-methoxy-5-methyl-phenyl)-1-(2-thenyl)thiourea Formula: C21H21ClN2OS2 MolecularWeight: 416.98724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=S)N(CC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=S)N(CC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C21H21ClN2OS2/c1-15-11-19(20(25-2)12-18(15)22)23-21(26)24(14-17-9-6-10-27-17)13-16-7-4-3-5-8-16/h3-12H,13-14H2,1-2H3,(H,23,26)