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

Systemtic Name: 4-methyl-3-nitro-N-[3-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[3-[2-(1-piperidyl)thiazol-4-yl]phenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[3-[2-(1-piperidinyl)-4-thiazolyl]phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[3-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Traditional Name: 4-methyl-3-nitro-N-[3-(2-piperidinothiazol-4-yl)phenyl]benzamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O3S/c1-15-8-9-17(13-20(15)26(28)29)21(27)23-18-7-5-6-16(12-18)19-14-30-22(24-19)25-10-3-2-4-11-25/h5-9,12-14H,2-4,10-11H2,1H3,(H,23,27)