ethyl 5-azanyl-4-cyano-3-[[(3R)-3-methylpiperidin-1-yl]methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[(3R)-3-methylpiperidin-1-yl]methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[(3R)-3-methyl-1-piperidyl]methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(3R)-3-methyl-1-piperidinyl]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[(3R)-3-methylpiperidin-1-yl]methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[(3R)-3-methylpiperidino]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN2CCCC(C2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN2CCC[C@H](C2)C

InChI

InChI=1S/C15H21N3O2S/c1-3-20-15(19)13-12(11(7-16)14(17)21-13)9-18-6-4-5-10(2)8-18/h10H,3-6,8-9,17H2,1-2H3/t10-/m1/s1