4-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-3-pyrrol-1-yl-benzamide

Systemtic Name: 4-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-3-pyrrol-1-yl-benzamide Openeye Name: 4-methyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]-3-pyrrol-1-yl-benzamide CAS Name: 4-methyl-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-3-(1-pyrrolyl)benzamide IUPAC Name: 4-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-3-pyrrol-1-ylbenzamide Traditional Name: 4-methyl-N-(5-nosylthiazol-2-yl)-3-pyrrol-1-yl-benzamide Formula: C21H16N4O5S2 MolecularWeight: 468.50554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])N4C=CC=C4

InChI

InChI=1S/C21H16N4O5S2/c1-14-4-5-15(12-18(14)24-10-2-3-11-24)20(26)23-21-22-13-19(31-21)32(29,30)17-8-6-16(7-9-17)25(27)28/h2-13H,1H3,(H,22,23,26)