3-chloranyl-N-[6-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]hexyl]-4-propan-2-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[6-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]hexyl]-4-propan-2-ylsulfonyl-thiophene-2-carboxamide Openeye Name: 3-chloro-4-isopropylsulfonyl-N-[6-[4-[3-(2-methylpropanoylamino)phenyl]-1-piperidyl]hexyl]thiophene-2-carboxamide CAS Name: 3-chloro-N-[6-[4-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperidinyl]hexyl]-4-propan-2-ylsulfonyl-2-thiophenecarboxamide IUPAC Name: 3-chloro-N-[6-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]hexyl]-4-propan-2-ylsulfonylthiophene-2-carboxamide Traditional Name: 3-chloro-N-[6-[4-[3-(isobutyrylamino)phenyl]piperidino]hexyl]-4-isopropylsulfonyl-thiophene-2-carboxamide Formula: C29H42ClN3O4S2 MolecularWeight: 596.24448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCCCCCNC(=O)C3=C(C(=CS3)S(=O)(=O)C(C)C)Cl

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCCCCCNC(=O)C3=C(C(=CS3)S(=O)(=O)C(C)C)Cl

InChI

InChI=1S/C29H42ClN3O4S2/c1-20(2)28(34)32-24-11-9-10-23(18-24)22-12-16-33(17-13-22)15-8-6-5-7-14-31-29(35)27-26(30)25(19-38-27)39(36,37)21(3)4/h9-11,18-22H,5-8,12-17H2,1-4H3,(H,31,35)(H,32,34)