N-methyl-N-[2-(methylamino)-2-oxidanylidene-ethyl]-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-methyl-N-[2-(methylamino)-2-oxidanylidene-ethyl]-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzamide Openeye Name: N-methyl-N-[2-(methylamino)-2-oxo-ethyl]-5-(1-piperidylsulfonyl)-2-pyrrolidin-1-yl-benzamide CAS Name: N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-(1-piperidinylsulfonyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-methyl-N-[2-(methylamino)-2-oxoethyl]-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-keto-2-(methylamino)ethyl]-N-methyl-5-piperidinosulfonyl-2-pyrrolidino-benzamide Formula: C20H30N4O4S MolecularWeight: 422.5416

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)C(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)N3CCCC3

Isomeric SMILES

CNC(=O)CN(C)C(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)N3CCCC3

InChI

InChI=1S/C20H30N4O4S/c1-21-19(25)15-22(2)20(26)17-14-16(8-9-18(17)23-10-6-7-11-23)29(27,28)24-12-4-3-5-13-24/h8-9,14H,3-7,10-13,15H2,1-2H3,(H,21,25)