ethyl 5-azanyl-4-cyano-3-[[(3-methoxyphenyl)methyl-methyl-amino]methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[(3-methoxyphenyl)methyl-methyl-amino]methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[(3-methoxyphenyl)methyl-methyl-amino]methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(3-methoxyphenyl)methyl-methylamino]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[(3-methoxyphenyl)methyl-methylamino]methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[m-anisyl(methyl)amino]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN(C)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN(C)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C18H21N3O3S/c1-4-24-18(22)16-15(14(9-19)17(20)25-16)11-21(2)10-12-6-5-7-13(8-12)23-3/h5-8H,4,10-11,20H2,1-3H3