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

Systemtic Name: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[4-(4-chlorophenyl)thiazol-2-yl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[4-(4-chlorophenyl)-2-thiazolyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[4-(4-chlorophenyl)thiazol-2-yl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C22H21ClN4O3S MolecularWeight: 456.94514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H21ClN4O3S/c1-14-8-10-26(11-9-14)19-7-4-16(12-20(19)27(29)30)21(28)25-22-24-18(13-31-22)15-2-5-17(23)6-3-15/h2-7,12-14H,8-11H2,1H3,(H,24,25,28)