1-butyl-3-(3-chlorophenyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-butyl-3-(3-chlorophenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-butyl-3-(3-chlorophenyl)thiourea CAS Name: 1-butyl-3-(3-chlorophenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-butyl-3-(3-chlorophenyl)thiourea Traditional Name: 1-benzyl-1-butyl-3-(3-chlorophenyl)thiourea Formula: C18H21ClN2S MolecularWeight: 332.89074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=S)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=S)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H21ClN2S/c1-2-3-12-21(14-15-8-5-4-6-9-15)18(22)20-17-11-7-10-16(19)13-17/h4-11,13H,2-3,12,14H2,1H3,(H,20,22)