ethyl 2-azanyl-4-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]methyl]-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]methyl]-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-amino-4-[[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]methyl]-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-amino-4-[[(2-methoxy-5-methylphenyl)methyl-methylamino]methyl]-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[[(2-methoxy-5-methylphenyl)methyl-methylamino]methyl]-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-amino-4-[[(2-methoxy-5-methyl-benzyl)-methyl-amino]methyl]-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CN(C)CC2=C(C=CC(=C2)C)OC)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CN(C)CC2=C(C=CC(=C2)C)OC)C(=O)NC)N

InChI

InChI=1S/C20H27N3O4S/c1-6-27-20(25)16-14(17(19(24)22-3)28-18(16)21)11-23(4)10-13-9-12(2)7-8-15(13)26-5/h7-9H,6,10-11,21H2,1-5H3,(H,22,24)