ethyl 2-[(3-fluorophenyl)methylamino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 2-[(3-fluorophenyl)methylamino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 2-[(3-fluorophenyl)methylamino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-[(3-fluorophenyl)methylamino]-3-[(4-methoxyanilino)-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-fluorophenyl)methylamino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-[(3-fluorobenzyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C25H26FN3O4S MolecularWeight: 483.555043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)OC)NCC4=CC(=CC=C4)F

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)OC)NCC4=CC(=CC=C4)F

InChI

InChI=1S/C25H26FN3O4S/c1-3-33-25(31)29-12-11-20-21(15-29)34-24(27-14-16-5-4-6-17(26)13-16)22(20)23(30)28-18-7-9-19(32-2)10-8-18/h4-10,13,27H,3,11-12,14-15H2,1-2H3,(H,28,30)