4-[2-(4-chlorophenyl)sulfanylethylamino]-3-nitro-benzamide

Systemtic Name: 4-[2-(4-chlorophenyl)sulfanylethylamino]-3-nitro-benzamide Openeye Name: 4-[2-(4-chlorophenyl)sulfanylethylamino]-3-nitro-benzamide CAS Name: 4-[2-[(4-chlorophenyl)thio]ethylamino]-3-nitrobenzamide IUPAC Name: 4-[2-(4-chlorophenyl)sulfanylethylamino]-3-nitrobenzamide Traditional Name: 4-[2-[(4-chlorophenyl)thio]ethylamino]-3-nitro-benzamide Formula: C15H14ClN3O3S MolecularWeight: 351.80796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1SCCNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H14ClN3O3S/c16-11-2-4-12(5-3-11)23-8-7-18-13-6-1-10(15(17)20)9-14(13)19(21)22/h1-6,9,18H,7-8H2,(H2,17,20)