ethyl 2-azanyl-5-(methylcarbamoyl)-4-[[[(1R)-1-naphthalen-1-ylethyl]amino]methyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-(methylcarbamoyl)-4-[[[(1R)-1-naphthalen-1-ylethyl]amino]methyl]thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-(methylcarbamoyl)-4-[[[(1R)-1-(1-naphthyl)ethyl]amino]methyl]thiophene-3-carboxylate CAS Name: 2-amino-5-(methylcarbamoyl)-4-[[[(1R)-1-(1-naphthalenyl)ethyl]amino]methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-(methylcarbamoyl)-4-[[[(1R)-1-naphthalen-1-ylethyl]amino]methyl]thiophene-3-carboxylate Traditional Name: 2-amino-5-(methylcarbamoyl)-4-[[[(1R)-1-(1-naphthyl)ethyl]amino]methyl]thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CNC(C)C2=CC=CC3=CC=CC=C32)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CN[C@H](C)C2=CC=CC3=CC=CC=C32)C(=O)NC)N

InChI

InChI=1S/C22H25N3O3S/c1-4-28-22(27)18-17(19(21(26)24-3)29-20(18)23)12-25-13(2)15-11-7-9-14-8-5-6-10-16(14)15/h5-11,13,25H,4,12,23H2,1-3H3,(H,24,26)/t13-/m1/s1