N-[2-(azepan-1-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-(1-azepanyl)ethyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCN3CCCCCC3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCN3CCCCCC3

InChI

InChI=1S/C21H33N3O3S/c1-18-10-15-24(16-11-18)28(26,27)20-8-6-19(7-9-20)21(25)22-12-17-23-13-4-2-3-5-14-23/h6-9,18H,2-5,10-17H2,1H3,(H,22,25)