N-[1-[4-(cyclopropylcarbonylamino)phenyl]ethyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[1-[4-(cyclopropylcarbonylamino)phenyl]ethyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[1-[4-[[cyclopropyl(oxo)methyl]amino]phenyl]ethyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC(C)C3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC(C)C3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C25H31N3O4S/c1-17-6-13-22(33(31,32)28-14-4-3-5-15-28)16-23(17)25(30)26-18(2)19-9-11-21(12-10-19)27-24(29)20-7-8-20/h6,9-13,16,18,20H,3-5,7-8,14-15H2,1-2H3,(H,26,30)(H,27,29)