3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(5-prop-2-enylsulfanyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(5-prop-2-enylsulfanyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide Openeye Name: N-[2-(5-allylsulfanyl-1,3,4-oxadiazol-2-yl)phenyl]-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-[5-(prop-2-enylthio)-1,3,4-oxadiazol-2-yl]phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(5-prop-2-enylsulfanyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide Traditional Name: N-[2-[5-(allylthio)-1,3,4-oxadiazol-2-yl]phenyl]-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide Formula: C24H25ClN4O4S2 MolecularWeight: 533.0627

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(O1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

C=CCSC1=NN=C(O1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H25ClN4O4S2/c1-2-15-34-24-28-27-23(33-24)18-9-5-6-10-20(18)26-22(30)17-11-12-19(25)21(16-17)35(31,32)29-13-7-3-4-8-14-29/h2,5-6,9-12,16H,1,3-4,7-8,13-15H2,(H,26,30)