N-[3-(ethylcarbamoyl)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: N-[3-(ethylcarbamoyl)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-[3-(ethylcarbamoyl)phenyl]-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-[3-(ethylcarbamoyl)phenyl]-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-[3-(ethylcarbamoyl)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-[3-(ethylcarbamoyl)phenyl]-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)SC3=NC(=CS3)C)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)SC3=NC(=CS3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S2/c1-3-21-18(25)13-5-4-6-15(9-13)23-19(26)14-7-8-17(16(10-14)24(27)28)30-20-22-12(2)11-29-20/h4-11H,3H2,1-2H3,(H,21,25)(H,23,26)