N-[2-(azepan-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]cyclobutanecarboxamide

Systemtic Name: N-[2-(azepan-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]cyclobutanecarboxamide Openeye Name: N-[2-(azepan-1-yl)-5-(1-piperidylsulfonyl)phenyl]cyclobutanecarboxamide CAS Name: N-[2-(1-azepanyl)-5-(1-piperidinylsulfonyl)phenyl]cyclobutanecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-piperidin-1-ylsulfonylphenyl]cyclobutanecarboxamide Traditional Name: N-[2-(azepan-1-yl)-5-piperidinosulfonyl-phenyl]cyclobutanecarboxamide Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)C4CCC4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)C4CCC4

InChI

InChI=1S/C22H33N3O3S/c26-22(18-9-8-10-18)23-20-17-19(29(27,28)25-15-6-3-7-16-25)11-12-21(20)24-13-4-1-2-5-14-24/h11-12,17-18H,1-10,13-16H2,(H,23,26)