3-(2-chloranyl-4,6-dimethyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea

Systemtic Name: 3-(2-chloranyl-4,6-dimethyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Openeye Name: 3-(2-chloro-4,6-dimethyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea CAS Name: 3-(2-chloro-4,6-dimethylphenyl)-1-(2-cyanoethyl)-1-methylthiourea IUPAC Name: 3-(2-chloro-4,6-dimethylphenyl)-1-(2-cyanoethyl)-1-methylthiourea Traditional Name: 3-(2-chloro-4,6-dimethyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Formula: C13H16ClN3S MolecularWeight: 281.80424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3S/c1-9-7-10(2)12(11(14)8-9)16-13(18)17(3)6-4-5-15/h7-8H,4,6H2,1-3H3,(H,16,18)