N-(1,3-benzothiazol-2-yl)-N-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-methyl-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-methyl-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-methyl-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-methyl-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N4O3S/c1-14-9-11-24(12-10-14)18-8-7-15(25(27)28)13-16(18)20(26)23(2)21-22-17-5-3-4-6-19(17)29-21/h3-8,13-14H,9-12H2,1-2H3