4-chloranyl-N-[[5-[4-(heptylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-[4-(heptylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-[4-(heptylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[4-(heptylamino)-1-azepanyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[4-(heptylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[4-(heptylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide Formula: C25H36ClN3O3S2 MolecularWeight: 526.15464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1CCCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCCNC1CCCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H36ClN3O3S2/c1-2-3-4-5-6-16-27-22-8-7-17-29(18-15-22)34(31,32)24-14-13-23(33-24)19-28-25(30)20-9-11-21(26)12-10-20/h9-14,22,27H,2-8,15-19H2,1H3,(H,28,30)