N-(2-methyl-6-propan-2-yl-phenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-morpholino-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-morpholino-5-piperidinosulfonyl-benzamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4

InChI

InChI=1S/C26H35N3O4S/c1-19(2)22-9-7-8-20(3)25(22)27-26(30)23-18-21(34(31,32)29-12-5-4-6-13-29)10-11-24(23)28-14-16-33-17-15-28/h7-11,18-19H,4-6,12-17H2,1-3H3,(H,27,30)