ethyl 5-(1,3-benzodioxol-5-yl)-3-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-yl)-3-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-yl)-3-[[2-(2-methylthiazol-4-yl)acetyl]amino]thiophene-2-carboxylate CAS Name: 5-(1,3-benzodioxol-5-yl)-3-[[2-(2-methyl-4-thiazolyl)-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-yl)-3-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]thiophene-2-carboxylate Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-[[2-(2-methylthiazol-4-yl)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C20H18N2O5S2 MolecularWeight: 430.49732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)OCO3)NC(=O)CC4=CSC(=N4)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC3=C(C=C2)OCO3)NC(=O)CC4=CSC(=N4)C

InChI

InChI=1S/C20H18N2O5S2/c1-3-25-20(24)19-14(22-18(23)7-13-9-28-11(2)21-13)8-17(29-19)12-4-5-15-16(6-12)27-10-26-15/h4-6,8-9H,3,7,10H2,1-2H3,(H,22,23)