3-(3-chloranyl-4-methyl-phenyl)-1-(4-phenylbutyl)-1-(phenylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-(4-phenylbutyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(3-chloro-4-methyl-phenyl)-1-(4-phenylbutyl)thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-(4-phenylbutyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(3-chloro-4-methylphenyl)-1-(4-phenylbutyl)thiourea Traditional Name: 1-benzyl-3-(3-chloro-4-methyl-phenyl)-1-(4-phenylbutyl)thiourea Formula: C25H27ClN2S MolecularWeight: 423.01328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CCCCC2=CC=CC=C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CCCCC2=CC=CC=C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C25H27ClN2S/c1-20-15-16-23(18-24(20)26)27-25(29)28(19-22-13-6-3-7-14-22)17-9-8-12-21-10-4-2-5-11-21/h2-7,10-11,13-16,18H,8-9,12,17,19H2,1H3,(H,27,29)