ethyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-(1,3-benzothiazole-6-carbonylamino)-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazole-6-carbonylamino)-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(1,3-benzothiazole-6-carbonylamino)-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H15N3O3S2 MolecularWeight: 409.4814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC3=C(C=C2)N=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC3=C(C=C2)N=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O3S2/c1-2-26-19(25)17-16(12-6-4-3-5-7-12)22-20(28-17)23-18(24)13-8-9-14-15(10-13)27-11-21-14/h3-11H,2H2,1H3,(H,22,23,24)