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

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-(2-cyanoethyl)-1-methylthiourea IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-(2-cyanoethyl)-1-methylthiourea Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Formula: C12H14ClN3S MolecularWeight: 267.77766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3S/c1-9-4-5-10(8-11(9)13)15-12(17)16(2)7-3-6-14/h4-5,8H,3,7H2,1-2H3,(H,15,17)