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

Systemtic Name: 4-(4-methylpiperidin-1-yl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: 4-(4-methyl-1-piperidyl)-N-[4-(morpholinomethyl)thiazol-2-yl]-3-nitro-benzamide CAS Name: 4-(4-methyl-1-piperidinyl)-N-[4-(4-morpholinylmethyl)-2-thiazolyl]-3-nitrobenzamide IUPAC Name: 4-(4-methylpiperidin-1-yl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-(4-methylpiperidino)-N-[4-(morpholinomethyl)thiazol-2-yl]-3-nitro-benzamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CN4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CN4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O4S/c1-15-4-6-25(7-5-15)18-3-2-16(12-19(18)26(28)29)20(27)23-21-22-17(14-31-21)13-24-8-10-30-11-9-24/h2-3,12,14-15H,4-11,13H2,1H3,(H,22,23,27)