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

Systemtic Name: 4-(3-methylpiperidin-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-(3-methyl-1-piperidyl)-N-(5-methylthiazol-2-yl)-3-nitro-benzamide CAS Name: 4-(3-methyl-1-piperidinyl)-N-(5-methyl-2-thiazolyl)-3-nitrobenzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)-N-(5-methyl-1,3-thiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-(3-methylpiperidino)-N-(5-methylthiazol-2-yl)-3-nitro-benzamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=NC=C(S3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=NC=C(S3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3S/c1-11-4-3-7-20(10-11)14-6-5-13(8-15(14)21(23)24)16(22)19-17-18-9-12(2)25-17/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,18,19,22)