N-[1-(1-adamantyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloranyl-benzamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloranyl-benzamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide CAS Name: N-[1-(1-adamantyl)ethyl]-3-(1-azepanylsulfonyl)-4-chlorobenzamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chlorobenzamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide Formula: C25H35ClN2O3S MolecularWeight: 479.075

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C25H35ClN2O3S/c1-17(25-14-18-10-19(15-25)12-20(11-18)16-25)27-24(29)21-6-7-22(26)23(13-21)32(30,31)28-8-4-2-3-5-9-28/h6-7,13,17-20H,2-5,8-12,14-16H2,1H3,(H,27,29)