3-azanyl-N-(3-cyanophenyl)-5-(furan-2-ylmethylamino)-4-pyrrolidin-1-ylcarbonyl-thiophene-2-carboxamide

Systemtic Name: 3-azanyl-N-(3-cyanophenyl)-5-(furan-2-ylmethylamino)-4-pyrrolidin-1-ylcarbonyl-thiophene-2-carboxamide Openeye Name: 3-amino-N-(3-cyanophenyl)-5-(2-furylmethylamino)-4-(pyrrolidine-1-carbonyl)thiophene-2-carboxamide CAS Name: 3-amino-N-(3-cyanophenyl)-5-(2-furanylmethylamino)-4-[oxo(1-pyrrolidinyl)methyl]-2-thiophenecarboxamide IUPAC Name: 3-amino-N-(3-cyanophenyl)-5-(furan-2-ylmethylamino)-4-(pyrrolidine-1-carbonyl)thiophene-2-carboxamide Traditional Name: 3-amino-N-(3-cyanophenyl)-5-(2-furfurylamino)-4-(pyrrolidine-1-carbonyl)thiophene-2-carboxamide Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(SC(=C2N)C(=O)NC3=CC=CC(=C3)C#N)NCC4=CC=CO4

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(SC(=C2N)C(=O)NC3=CC=CC(=C3)C#N)NCC4=CC=CO4

InChI

InChI=1S/C22H21N5O3S/c23-12-14-5-3-6-15(11-14)26-20(28)19-18(24)17(22(29)27-8-1-2-9-27)21(31-19)25-13-16-7-4-10-30-16/h3-7,10-11,25H,1-2,8-9,13,24H2,(H,26,28)