ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-4-cyclopropyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-4-cyclopropyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-4-cyclopropyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-4-cyclopropyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-4-cyclopropylthiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-4-cyclopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H18N2O4S2 MolecularWeight: 402.48722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H18N2O4S2/c1-2-24-18(23)16-12(11-7-8-11)9-26-17(16)21-15(22)10-27-19-20-13-5-3-4-6-14(13)25-19/h3-6,9,11H,2,7-8,10H2,1H3,(H,21,22)