1-butyl-3-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 1-butyl-3-[(4-methylphenyl)methyl]thiourea Openeye Name: 1-butyl-3-(p-tolylmethyl)thiourea CAS Name: 1-butyl-3-[(4-methylphenyl)methyl]thiourea IUPAC Name: 1-butyl-3-[(4-methylphenyl)methyl]thiourea Traditional Name: 1-butyl-3-(4-methylbenzyl)thiourea Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCC1=CC=C(C=C1)C

Isomeric SMILES

CCCCNC(=S)NCC1=CC=C(C=C1)C

InChI

InChI=1S/C13H20N2S/c1-3-4-9-14-13(16)15-10-12-7-5-11(2)6-8-12/h5-8H,3-4,9-10H2,1-2H3,(H2,14,15,16)