ethyl 2-[[5-(1,3-benzothiazol-2-yl)thiophen-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[[5-(1,3-benzothiazol-2-yl)thiophen-2-yl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[5-(1,3-benzothiazol-2-yl)thiophene-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[5-(1,3-benzothiazol-2-yl)-2-thiophenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(1,3-benzothiazol-2-yl)thiophene-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[5-(1,3-benzothiazol-2-yl)thiophene-2-carbonyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C22H15N3O3S3 MolecularWeight: 465.5678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H15N3O3S3/c1-2-28-21(27)12-7-8-14-18(11-12)31-22(24-14)25-19(26)16-9-10-17(29-16)20-23-13-5-3-4-6-15(13)30-20/h3-11H,2H2,1H3,(H,24,25,26)