1-(2-cyanoethyl)-3-(4-ethylphenyl)-1-methyl-thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-ethylphenyl)-1-methyl-thiourea Openeye Name: 1-(2-cyanoethyl)-3-(4-ethylphenyl)-1-methyl-thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-ethylphenyl)-1-methylthiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-ethylphenyl)-1-methylthiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-ethylphenyl)-1-methyl-thiourea Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(C)CCC#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(C)CCC#N

InChI

InChI=1S/C13H17N3S/c1-3-11-5-7-12(8-6-11)15-13(17)16(2)10-4-9-14/h5-8H,3-4,10H2,1-2H3,(H,15,17)