ethyl 2-(2-methylpropylamino)-5-(naphthalen-1-ylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-methylpropylamino)-5-(naphthalen-1-ylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(isobutylamino)-5-(1-naphthylmethyl)thiophene-3-carboxylate CAS Name: 2-(2-methylpropylamino)-5-(1-naphthalenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-methylpropylamino)-5-(naphthalen-1-ylmethyl)thiophene-3-carboxylate Traditional Name: 2-(isobutylamino)-5-(1-naphthylmethyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H25NO2S MolecularWeight: 367.5044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC3=CC=CC=C32)NCC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC3=CC=CC=C32)NCC(C)C

InChI

InChI=1S/C22H25NO2S/c1-4-25-22(24)20-13-18(26-21(20)23-14-15(2)3)12-17-10-7-9-16-8-5-6-11-19(16)17/h5-11,13,15,23H,4,12,14H2,1-3H3