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

Systemtic Name: ethyl 2-[3-[[2-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]pyridin-2-yl]ethanoate Openeye Name: ethyl 2-[3-[[2-(2-methoxy-2-oxo-ethyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]-2-pyridyl]acetate CAS Name: 2-[3-[[[2-[(2-methoxy-2-oxoethyl)thio]-1,3-benzothiazol-6-yl]amino]-oxomethyl]-2-pyridinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[2-(2-methoxy-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]carbamoyl]pyridin-2-yl]acetate Traditional Name: 2-[3-[[2-[(2-keto-2-methoxy-ethyl)thio]-1,3-benzothiazol-6-yl]carbamoyl]-2-pyridyl]acetic acid ethyl ester Formula: C20H19N3O5S2 MolecularWeight: 445.51196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5S2/c1-3-28-17(24)10-15-13(5-4-8-21-15)19(26)22-12-6-7-14-16(9-12)30-20(23-14)29-11-18(25)27-2/h4-9H,3,10-11H2,1-2H3,(H,22,26)