1-(2-chloroethyl)-3-[4-(4-cyanophenyl)-2-methylsulfanyl-phenyl]urea

Systemtic Name: 1-(2-chloroethyl)-3-[4-(4-cyanophenyl)-2-methylsulfanyl-phenyl]urea Openeye Name: 1-(2-chloroethyl)-3-[4-(4-cyanophenyl)-2-methylsulfanyl-phenyl]urea CAS Name: 1-(2-chloroethyl)-3-[4-(4-cyanophenyl)-2-(methylthio)phenyl]urea IUPAC Name: 1-(2-chloroethyl)-3-[4-(4-cyanophenyl)-2-methylsulfanylphenyl]urea Traditional Name: 1-(2-chloroethyl)-3-[4-(4-cyanophenyl)-2-(methylthio)phenyl]urea Formula: C17H16ClN3OS MolecularWeight: 345.84644

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)NC(=O)NCCCl

Isomeric SMILES

CSC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)NC(=O)NCCCl

InChI

InChI=1S/C17H16ClN3OS/c1-23-16-10-14(13-4-2-12(11-19)3-5-13)6-7-15(16)21-17(22)20-9-8-18/h2-7,10H,8-9H2,1H3,(H2,20,21,22)