1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(2-methylpropyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(2-methylpropyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-isobutyl-thiourea CAS Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(2-methylpropyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(2-methylpropyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-isobutyl-thiourea Formula: C16H23N3S MolecularWeight: 289.43892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CCC#N)CC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CCC#N)CC(C)C)C

InChI

InChI=1S/C16H23N3S/c1-12(2)11-19(9-5-8-17)16(20)18-15-7-6-13(3)14(4)10-15/h6-7,10,12H,5,9,11H2,1-4H3,(H,18,20)