butyl 2-(thiophen-2-ylcarbonylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-(thiophen-2-ylcarbonylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-(thiophene-2-carbonylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-(thiophene-2-carbonylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(2-thenoylamino)-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C17H16N2O3S2 MolecularWeight: 360.45054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CS3

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C17H16N2O3S2/c1-2-3-8-22-16(21)11-6-7-12-14(10-11)24-17(18-12)19-15(20)13-5-4-9-23-13/h4-7,9-10H,2-3,8H2,1H3,(H,18,19,20)