4-methyl-3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-benzothiazol-6-yl]carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 4-methyl-3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-benzothiazol-6-yl]carbonylamino]thiophene-2-carboxylic acid Openeye Name: 3-[[2-(tert-butoxycarbonylamino)-1,3-benzothiazole-6-carbonyl]amino]-4-methyl-thiophene-2-carboxylic acid CAS Name: 4-methyl-3-[[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,3-benzothiazol-6-yl]-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 4-methyl-3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-benzothiazole-6-carbonyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[[2-(tert-butoxycarbonylamino)-1,3-benzothiazole-6-carbonyl]amino]-4-methyl-2-thenoic acid Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=CSC(=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C19H19N3O5S2/c1-9-8-28-14(16(24)25)13(9)21-15(23)10-5-6-11-12(7-10)29-17(20-11)22-18(26)27-19(2,3)4/h5-8H,1-4H3,(H,21,23)(H,24,25)(H,20,22,26)