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

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)thiourea Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCC#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCC#N)C

InChI

InChI=1S/C12H15N3S/c1-9-4-5-11(8-10(9)2)15-12(16)14-7-3-6-13/h4-5,8H,3,7H2,1-2H3,(H2,14,15,16)