N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[1-(2-methylpropanoyl)-4-piperidyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(1-isobutyryl-4-piperidyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C20H28N4O5S/c1-14(2)20(27)23-9-6-16(7-10-23)22-19(26)15-4-3-5-17(12-15)30(28,29)24-11-8-21-18(25)13-24/h3-5,12,14,16H,6-11,13H2,1-2H3,(H,21,25)(H,22,26)