3-(4-methylpiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-[(4-methyl-1-piperazinyl)sulfonyl]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-(4-methylpiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C19H27N5O3S2 MolecularWeight: 437.57938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C19H27N5O3S2/c1-3-4-5-9-17-21-22-19(28-17)20-18(25)15-7-6-8-16(14-15)29(26,27)24-12-10-23(2)11-13-24/h6-8,14H,3-5,9-13H2,1-2H3,(H,20,22,25)