N-[3-methyl-1-oxidanylidene-1-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[(3-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[3-(1-pyrrolidinylsulfonyl)anilino]butan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-(3-pyrrolidin-1-ylsulfonylanilino)butan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[(3-pyrrolidinosulfonylphenyl)carbamoyl]propyl]thiophene-2-carboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H25N3O4S2/c1-14(2)18(22-19(24)17-9-6-12-28-17)20(25)21-15-7-5-8-16(13-15)29(26,27)23-10-3-4-11-23/h5-9,12-14,18H,3-4,10-11H2,1-2H3,(H,21,25)(H,22,24)