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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=NC4=CC=CC=C4S3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=NC4=CC=CC=C4S3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-13-5-4-10-23(12-13)16-9-8-14(11-17(16)24(26)27)19(25)22-20-21-15-6-2-3-7-18(15)28-20/h2-3,6-9,11,13H,4-5,10,12H2,1H3,(H,21,22,25)