1-(4-butylphenyl)-3-(2,2-diphenylethyl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(2,2-diphenylethyl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(2,2-diphenylethyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(2,2-diphenylethyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(2,2-diphenylethyl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(2,2-diphenylethyl)thiourea Formula: C25H28N2S MolecularWeight: 388.56822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2S/c1-2-3-10-20-15-17-23(18-16-20)27-25(28)26-19-24(21-11-6-4-7-12-21)22-13-8-5-9-14-22/h4-9,11-18,24H,2-3,10,19H2,1H3,(H2,26,27,28)