2-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-methyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-methyl-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-methyl-N-(5-nosylthiazol-2-yl)-1,3-benzothiazole-6-carboxamide Formula: C18H12N4O5S3 MolecularWeight: 460.50668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O5S3/c1-10-20-14-7-2-11(8-15(14)28-10)17(23)21-18-19-9-16(29-18)30(26,27)13-5-3-12(4-6-13)22(24)25/h2-9H,1H3,(H,19,21,23)