1-(2-cyanoethyl)-3-(3,5-dimethylphenyl)-1-(thiophen-2-ylmethyl)urea

Systemtic Name: 1-(2-cyanoethyl)-3-(3,5-dimethylphenyl)-1-(thiophen-2-ylmethyl)urea Openeye Name: 1-(2-cyanoethyl)-3-(3,5-dimethylphenyl)-1-(2-thienylmethyl)urea CAS Name: 1-(2-cyanoethyl)-3-(3,5-dimethylphenyl)-1-(thiophen-2-ylmethyl)urea IUPAC Name: 1-(2-cyanoethyl)-3-(3,5-dimethylphenyl)-1-(thiophen-2-ylmethyl)urea Traditional Name: 1-(2-cyanoethyl)-3-(3,5-dimethylphenyl)-1-(2-thenyl)urea Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)N(CCC#N)CC2=CC=CS2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)N(CCC#N)CC2=CC=CS2)C

InChI

InChI=1S/C17H19N3OS/c1-13-9-14(2)11-15(10-13)19-17(21)20(7-4-6-18)12-16-5-3-8-22-16/h3,5,8-11H,4,7,12H2,1-2H3,(H,19,21)