4-(2-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-3-nitro-benzamide

Systemtic Name: 4-(2-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-3-nitro-benzamide Openeye Name: 4-(2-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-3-nitro-benzamide CAS Name: 4-[(2-chlorophenyl)thio]-N-(2-dimethylaminoethyl)-3-nitrobenzamide IUPAC Name: 4-(2-chlorophenyl)sulfanyl-N-(2-dimethylaminoethyl)-3-nitrobenzamide Traditional Name: 4-[(2-chlorophenyl)thio]-N-(2-dimethylaminoethyl)-3-nitro-benzamide Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN3O3S/c1-20(2)10-9-19-17(22)12-7-8-16(14(11-12)21(23)24)25-15-6-4-3-5-13(15)18/h3-8,11H,9-10H2,1-2H3,(H,19,22)