1-(4-butylphenyl)-3-[(3,5-dimethylphenyl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(3,5-dimethylphenyl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(3,5-dimethylphenyl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(3,5-dimethylphenyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(3,5-dimethylphenyl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-(3,5-dimethylbenzyl)thiourea Formula: C20H26N2S MolecularWeight: 326.49884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H26N2S/c1-4-5-6-17-7-9-19(10-8-17)22-20(23)21-14-18-12-15(2)11-16(3)13-18/h7-13H,4-6,14H2,1-3H3,(H2,21,22,23)