4-(2-methylpiperidin-1-yl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[(2-methyl-1-piperidyl)sulfonyl]-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(2-methyl-1-piperidinyl)sulfonyl]-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(2-methylpiperidino)sulfonyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Formula: C20H20N4O5S2 MolecularWeight: 460.5266

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5S2/c1-13-4-2-3-11-23(13)31(28,29)16-8-5-14(6-9-16)19(25)22-20-21-17-10-7-15(24(26)27)12-18(17)30-20/h5-10,12-13H,2-4,11H2,1H3,(H,21,22,25)