3-(5-chloranyl-2-methoxy-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-(2-cyanoethyl)-1-methylthiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1-(2-cyanoethyl)-1-methylthiourea Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Formula: C12H14ClN3OS MolecularWeight: 283.77706

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=S)NC1=C(C=CC(=C1)Cl)OC

Isomeric SMILES

CN(CCC#N)C(=S)NC1=C(C=CC(=C1)Cl)OC

InChI

InChI=1S/C12H14ClN3OS/c1-16(7-3-6-14)12(18)15-10-8-9(13)4-5-11(10)17-2/h4-5,8H,3,7H2,1-2H3,(H,15,18)