1-(4-butan-2-ylphenyl)-3-(4-phenylbutyl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(4-phenylbutyl)thiourea Openeye Name: 1-(4-phenylbutyl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(4-phenylbutyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(4-phenylbutyl)thiourea Traditional Name: 1-(4-phenylbutyl)-3-(4-sec-butylphenyl)thiourea Formula: C21H28N2S MolecularWeight: 340.52542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NCCCCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NCCCCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2S/c1-3-17(2)19-12-14-20(15-13-19)23-21(24)22-16-8-7-11-18-9-5-4-6-10-18/h4-6,9-10,12-15,17H,3,7-8,11,16H2,1-2H3,(H2,22,23,24)