4-azanyl-5-(3-methyl-5-nitro-thiophen-2-yl)carbonyl-2-(1,3-thiazol-2-ylamino)benzenesulfonamide

Systemtic Name: 4-azanyl-5-(3-methyl-5-nitro-thiophen-2-yl)carbonyl-2-(1,3-thiazol-2-ylamino)benzenesulfonamide Openeye Name: 4-amino-5-(3-methyl-5-nitro-thiophene-2-carbonyl)-2-(thiazol-2-ylamino)benzenesulfonamide CAS Name: 4-amino-5-[(3-methyl-5-nitro-2-thiophenyl)-oxomethyl]-2-(2-thiazolylamino)benzenesulfonamide IUPAC Name: 4-amino-5-(3-methyl-5-nitrothiophene-2-carbonyl)-2-(1,3-thiazol-2-ylamino)benzenesulfonamide Traditional Name: 4-amino-5-(3-methyl-5-nitro-thiophene-2-carbonyl)-2-(thiazol-2-ylamino)benzenesulfonamide Formula: C15H13N5O5S3 MolecularWeight: 439.48922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)[N+](=O)[O-])C(=O)C2=CC(=C(C=C2N)NC3=NC=CS3)S(=O)(=O)N

Isomeric SMILES

CC1=C(SC(=C1)[N+](=O)[O-])C(=O)C2=CC(=C(C=C2N)NC3=NC=CS3)S(=O)(=O)N

InChI

InChI=1S/C15H13N5O5S3/c1-7-4-12(20(22)23)27-14(7)13(21)8-5-11(28(17,24)25)10(6-9(8)16)19-15-18-2-3-26-15/h2-6H,16H2,1H3,(H,18,19)(H2,17,24,25)