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

Systemtic Name: ethyl 2-[1,3-benzothiazol-6-ylcarbonyl(pentyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[1,3-benzothiazole-6-carbonyl(pentyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]-pentylamino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1,3-benzothiazole-6-carbonyl(pentyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl(1,3-benzothiazole-6-carbonyl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H23N3O3S2 MolecularWeight: 417.54492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C20H23N3O3S2/c1-4-6-7-10-23(20-22-13(3)17(28-20)19(25)26-5-2)18(24)14-8-9-15-16(11-14)27-12-21-15/h8-9,11-12H,4-7,10H2,1-3H3