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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)N4CCC(CC4)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)N4CCC(CC4)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4S/c1-3-30-16-5-6-17-20(13-16)31-22(23-17)24-21(27)15-4-7-18(19(12-15)26(28)29)25-10-8-14(2)9-11-25/h4-7,12-14H,3,8-11H2,1-2H3,(H,23,24,27)