1-(3-methylpiperidin-1-yl)-2-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]ethanone

Systemtic Name: 1-(3-methylpiperidin-1-yl)-2-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]ethanone Openeye Name: 1-(3-methyl-1-piperidyl)-2-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-anilino)ethanone CAS Name: 1-(3-methyl-1-piperidinyl)-2-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)anilino]ethanone IUPAC Name: 1-(3-methylpiperidin-1-yl)-2-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylanilino)ethanone Traditional Name: 1-(3-methylpiperidino)-2-(5-morpholinosulfonyl-2-pyrrolidino-anilino)ethanone Formula: C22H34N4O4S MolecularWeight: 450.59476

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CNC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

CC1CCCN(C1)C(=O)CNC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C22H34N4O4S/c1-18-5-4-10-25(17-18)22(27)16-23-20-15-19(6-7-21(20)24-8-2-3-9-24)31(28,29)26-11-13-30-14-12-26/h6-7,15,18,23H,2-5,8-14,16-17H2,1H3