3-(3,4-dimethylphenyl)sulfanyl-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(4-nitrophenyl)propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(4-nitrophenyl)propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(4-nitrophenyl)propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-(4-nitrophenyl)propionamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O3S/c1-12-3-8-16(11-13(12)2)23-10-9-17(20)18-14-4-6-15(7-5-14)19(21)22/h3-8,11H,9-10H2,1-2H3,(H,18,20)