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

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-phenyl-thiourea Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-phenyl-thiourea CAS Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-phenylthiourea IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-phenylthiourea Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-phenyl-thiourea Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CCC#N)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CCC#N)C2=CC=CC=C2)C

InChI

InChI=1S/C18H19N3S/c1-14-9-10-16(13-15(14)2)20-18(22)21(12-6-11-19)17-7-4-3-5-8-17/h3-5,7-10,13H,6,12H2,1-2H3,(H,20,22)