methyl 2-(butylcarbamoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-(butylcarbamoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-(butylcarbamoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[butylamino(oxo)methyl]amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(butylcarbamoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-(butylcarbamoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(C2=C(S1)CNCC2)C(=O)OC

Isomeric SMILES

CCCCNC(=O)NC1=C(C2=C(S1)CNCC2)C(=O)OC

InChI

InChI=1S/C14H21N3O3S/c1-3-4-6-16-14(19)17-12-11(13(18)20-2)9-5-7-15-8-10(9)21-12/h15H,3-8H2,1-2H3,(H2,16,17,19)