ethyl 4-(1,3-benzothiazol-2-yl)-5-(cyclopropylcarbonylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-(1,3-benzothiazol-2-yl)-5-(cyclopropylcarbonylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-(1,3-benzothiazol-2-yl)-5-(cyclopropanecarbonylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 4-(1,3-benzothiazol-2-yl)-5-[[cyclopropyl(oxo)methyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzothiazol-2-yl)-5-(cyclopropanecarbonylamino)-3-methylthiophene-2-carboxylate Traditional Name: 4-(1,3-benzothiazol-2-yl)-5-(cyclopropanecarbonylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CC2)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CC2)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C19H18N2O3S2/c1-3-24-19(23)15-10(2)14(18(26-15)21-16(22)11-8-9-11)17-20-12-6-4-5-7-13(12)25-17/h4-7,11H,3,8-9H2,1-2H3,(H,21,22)