ethyl 2-[3-[[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]pyridin-2-yl]ethanoate

Systemtic Name: ethyl 2-[3-[[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]pyridin-2-yl]ethanoate Openeye Name: ethyl 2-[3-[[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]-2-pyridyl]acetate CAS Name: 2-[3-[[[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]amino]-oxomethyl]-2-pyridinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]pyridin-2-yl]acetate Traditional Name: 2-[3-[[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]carbamoyl]-2-pyridyl]acetic acid ethyl ester Formula: C23H27N3O4S2 MolecularWeight: 473.60818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C=CC=N1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

Isomeric SMILES

CCOC(=O)CC1=C(C=CC=N1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

InChI

InChI=1S/C23H27N3O4S2/c1-5-30-20(27)14-18-16(7-6-11-24-18)21(28)25-15-8-9-17-19(13-15)32-22(26-17)31-12-10-23(2,3)29-4/h6-9,11,13H,5,10,12,14H2,1-4H3,(H,25,28)