N-[2-(4-methoxy-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-3-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-propanamide

Systemtic Name: N-[2-(4-methoxy-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-3-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-propanamide Openeye Name: N-[2-(4-methoxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-3-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-propanamide CAS Name: N-[2-(4-methoxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-3-[[2-oxo-2-(phenethylamino)ethyl]thio]propanamide IUPAC Name: N-[2-(4-methoxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-3-[2-oxo-2-(phenethylamino)ethyl]sulfanylpropanamide Traditional Name: N-[2-(2-keto-4-methoxy-3H-1,3-benzothiazol-7-yl)ethyl]-3-[[2-keto-2-(phenethylamino)ethyl]thio]propionamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)CCNC(=O)CCSCC(=O)NCCC3=CC=CC=C3)SC(=O)N2

Isomeric SMILES

COC1=C2C(=C(C=C1)CCNC(=O)CCSCC(=O)NCCC3=CC=CC=C3)SC(=O)N2

InChI

InChI=1S/C23H27N3O4S2/c1-30-18-8-7-17(22-21(18)26-23(29)32-22)10-13-24-19(27)11-14-31-15-20(28)25-12-9-16-5-3-2-4-6-16/h2-8H,9-15H2,1H3,(H,24,27)(H,25,28)(H,26,29)