4-oxidanylidene-4-(4-propoxyphenyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide

Systemtic Name: 4-oxidanylidene-4-(4-propoxyphenyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide Openeye Name: 4-oxo-4-(4-propoxyphenyl)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]butanamide CAS Name: 4-oxo-4-(4-propoxyphenyl)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]butanamide IUPAC Name: 4-oxo-4-(4-propoxyphenyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide Traditional Name: 4-keto-4-(4-propoxyphenyl)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]butyramide Formula: C22H28N2O5S2 MolecularWeight: 464.59812

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H28N2O5S2/c1-2-15-29-18-7-5-17(6-8-18)20(25)10-11-21(26)23-16-19-9-12-22(30-19)31(27,28)24-13-3-4-14-24/h5-9,12H,2-4,10-11,13-16H2,1H3,(H,23,26)