ethyl 2-[1,3-benzothiazol-6-ylcarbonyl-(phenylmethyl)amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[1,3-benzothiazol-6-ylcarbonyl-(phenylmethyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[1,3-benzothiazole-6-carbonyl(benzyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]-(phenylmethyl)amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1,3-benzothiazole-6-carbonyl(benzyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[1,3-benzothiazole-6-carbonyl(benzyl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C22H19N3O3S2 MolecularWeight: 437.53456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)N=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)N=CS4)C

InChI

InChI=1S/C22H19N3O3S2/c1-3-28-21(27)19-14(2)24-22(30-19)25(12-15-7-5-4-6-8-15)20(26)16-9-10-17-18(11-16)29-13-23-17/h4-11,13H,3,12H2,1-2H3