3-(azepan-1-ylsulfonyl)-4-methoxy-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[4-(4-pyridylmethyl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[4-(4-pyridylmethyl)phenyl]benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H29N3O4S/c1-33-24-11-8-22(19-25(24)34(31,32)29-16-4-2-3-5-17-29)26(30)28-23-9-6-20(7-10-23)18-21-12-14-27-15-13-21/h6-15,19H,2-5,16-18H2,1H3,(H,28,30)