4-(azepan-1-ylsulfonyl)-N-(phenylmethyl)-N-pyridin-2-yl-benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(phenylmethyl)-N-pyridin-2-yl-benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-(2-pyridyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(phenylmethyl)-N-(2-pyridinyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-pyridin-2-ylbenzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-benzyl-N-(2-pyridyl)benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C25H27N3O3S/c29-25(28(24-12-6-7-17-26-24)20-21-10-4-3-5-11-21)22-13-15-23(16-14-22)32(30,31)27-18-8-1-2-9-19-27/h3-7,10-17H,1-2,8-9,18-20H2