N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-oxo-propyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: N-[3-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-3-keto-propyl]-4-keto-4-(2-thienyl)butyramide Formula: C22H26FN3O5S2 MolecularWeight: 495.587343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)CCNC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)CCNC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C22H26FN3O5S2/c23-17-4-6-18(7-5-17)33(30,31)26-13-2-12-25(14-15-26)22(29)10-11-24-21(28)9-8-19(27)20-3-1-16-32-20/h1,3-7,16H,2,8-15H2,(H,24,28)