1-butyl-1-(phenylmethyl)-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-butyl-1-(phenylmethyl)-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-benzyl-1-butyl-3-(4-isopropylphenyl)thiourea CAS Name: 1-butyl-1-(phenylmethyl)-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-benzyl-1-butyl-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-benzyl-1-butyl-3-p-cumenyl-thiourea Formula: C21H28N2S MolecularWeight: 340.52542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2S/c1-4-5-15-23(16-18-9-7-6-8-10-18)21(24)22-20-13-11-19(12-14-20)17(2)3/h6-14,17H,4-5,15-16H2,1-3H3,(H,22,24)