2-chloranyl-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-[(3-methyl-1-piperidyl)methyl]thiazol-2-yl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-[(3-methyl-1-piperidinyl)methyl]-2-thiazolyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-[(3-methylpiperidino)methyl]thiazol-2-yl]-4-nitro-benzamide Formula: C17H19ClN4O3S MolecularWeight: 394.87576

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H19ClN4O3S/c1-11-3-2-6-21(8-11)9-12-10-26-17(19-12)20-16(23)14-5-4-13(22(24)25)7-15(14)18/h4-5,7,10-11H,2-3,6,8-9H2,1H3,(H,19,20,23)