3-(azepan-1-ylsulfonyl)-N-[[3-(cyclobutylcarbonylamino)phenyl]methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(cyclobutylcarbonylamino)phenyl]methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[[3-[[cyclobutyl(oxo)methyl]amino]phenyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[3-(cyclobutanecarbonylamino)benzyl]benzamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

InChI

InChI=1S/C25H31N3O4S/c29-24(26-18-19-8-5-12-22(16-19)27-25(30)20-9-6-10-20)21-11-7-13-23(17-21)33(31,32)28-14-3-1-2-4-15-28/h5,7-8,11-13,16-17,20H,1-4,6,9-10,14-15,18H2,(H,26,29)(H,27,30)