N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-3-pyrrolidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-3-pyrrolidin-1-ylsulfonyl-thiophene-2-carboxamide CAS Name: N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-3-(1-pyrrolidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-3-pyrrolidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[4-(pyrrolidine-1-carbonyl)benzyl]-3-pyrrolidinosulfonyl-thiophene-2-carboxamide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H25N3O4S2/c25-20(19-18(9-14-29-19)30(27,28)24-12-3-4-13-24)22-15-16-5-7-17(8-6-16)21(26)23-10-1-2-11-23/h5-9,14H,1-4,10-13,15H2,(H,22,25)