2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C17H13N5O4S2 MolecularWeight: 415.44622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O4S2/c1-26-10-3-4-11-12(7-10)19-16(18-11)27-8-15(23)21-17-20-13-6-9(22(24)25)2-5-14(13)28-17/h2-7H,8H2,1H3,(H,18,19)(H,20,21,23)