3-methyl-4-nitro-N-(3-phenylsulfanylpropyl)benzamide

Systemtic Name: 3-methyl-4-nitro-N-(3-phenylsulfanylpropyl)benzamide Openeye Name: 3-methyl-4-nitro-N-(3-phenylsulfanylpropyl)benzamide CAS Name: 3-methyl-4-nitro-N-[3-(phenylthio)propyl]benzamide IUPAC Name: 3-methyl-4-nitro-N-(3-phenylsulfanylpropyl)benzamide Traditional Name: 3-methyl-4-nitro-N-[3-(phenylthio)propyl]benzamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCSC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCCSC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O3S/c1-13-12-14(8-9-16(13)19(21)22)17(20)18-10-5-11-23-15-6-3-2-4-7-15/h2-4,6-9,12H,5,10-11H2,1H3,(H,18,20)