N-cyclopropyl-2-[methyl-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]amino]ethanamide

Systemtic Name: N-cyclopropyl-2-[methyl-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl]amino]ethanamide Openeye Name: N-cyclopropyl-2-[methyl-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-cyclopropyl-2-[methyl-[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-cyclopropyl-2-[methyl-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-cyclopropyl-2-[methyl-[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetyl]amino]acetamide Formula: C15H16N4O4S2 MolecularWeight: 380.44194

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1CC1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)NC1CC1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O4S2/c1-18(7-13(20)16-9-2-3-9)14(21)8-24-15-17-11-5-4-10(19(22)23)6-12(11)25-15/h4-6,9H,2-3,7-8H2,1H3,(H,16,20)