N-[1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-4-piperidyl]benzamide CAS Name: N-[1-[3-[4-(1-azepanylsulfonyl)phenyl]-1-oxopropyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-4-piperidyl]benzamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O4S/c31-26(29-20-16-24(17-21-29)28-27(32)23-8-4-3-5-9-23)15-12-22-10-13-25(14-11-22)35(33,34)30-18-6-1-2-7-19-30/h3-5,8-11,13-14,24H,1-2,6-7,12,15-21H2,(H,28,32)