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

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-(5-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C17H13N5O3S2 MolecularWeight: 399.44682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O3S2/c1-9-2-4-11-12(6-9)19-16(18-11)26-8-15(23)21-17-20-13-7-10(22(24)25)3-5-14(13)27-17/h2-7H,8H2,1H3,(H,18,19)(H,20,21,23)