ethyl 2-azanyl-5-(1,3-benzodioxol-5-ylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-(1,3-benzodioxol-5-ylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-(1,3-benzodioxol-5-ylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-amino-5-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-amino-5-(1,3-benzodioxol-5-ylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC3=C(C=C2)OCO3)N

InChI

InChI=1S/C16H16N2O5S/c1-3-21-16(20)12-8(2)13(24-14(12)17)15(19)18-9-4-5-10-11(6-9)23-7-22-10/h4-6H,3,7,17H2,1-2H3,(H,18,19)