3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]-N-methylsulfonyl-benzamide

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]-N-methylsulfonyl-benzamide Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]-N-methylsulfonyl-benzamide CAS Name: 3-[3-cyclopentyloxy-4-methoxy-N-(3-pyridinylmethyl)anilino]-N-methylsulfonylbenzamide IUPAC Name: 3-[3-cyclopentyloxy-4-methoxy-N-(pyridin-3-ylmethyl)anilino]-N-methylsulfonylbenzamide Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]-N-mesyl-benzamide Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C(=O)NS(=O)(=O)C)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C(=O)NS(=O)(=O)C)OC4CCCC4

InChI

InChI=1S/C26H29N3O5S/c1-33-24-13-12-22(16-25(24)34-23-10-3-4-11-23)29(18-19-7-6-14-27-17-19)21-9-5-8-20(15-21)26(30)28-35(2,31)32/h5-9,12-17,23H,3-4,10-11,18H2,1-2H3,(H,28,30)