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

Systemtic Name: 4-chloranyl-N-[[5-[4-(octylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[5-[4-(octylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[[4-(octylamino)-1-azepanyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[4-(octylamino)azepan-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[5-[4-(octylamino)azepan-1-yl]sulfonyl-2-thienyl]methyl]benzamide Formula: C26H38ClN3O3S2 MolecularWeight: 540.18122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1CCCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCCCNC1CCCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H38ClN3O3S2/c1-2-3-4-5-6-7-17-28-23-9-8-18-30(19-16-23)35(32,33)25-15-14-24(34-25)20-29-26(31)21-10-12-22(27)13-11-21/h10-15,23,28H,2-9,16-20H2,1H3,(H,29,31)