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

Systemtic Name: N-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-[(4-methyl-1-piperidyl)methyl]thiazol-2-yl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[4-[(4-methyl-1-piperidinyl)methyl]-2-thiazolyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-[4-[(4-methylpiperidino)methyl]thiazol-2-yl]benzamide Formula: C21H27N5O4S2 MolecularWeight: 477.60018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CC1CCN(CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C21H27N5O4S2/c1-15-5-8-25(9-6-15)12-17-14-31-21(23-17)24-20(28)16-3-2-4-18(11-16)32(29,30)26-10-7-22-19(27)13-26/h2-4,11,14-15H,5-10,12-13H2,1H3,(H,22,27)(H,23,24,28)