prop-2-enyl N-[2-[[6-(2-pyridin-2-ylsulfanylethanoylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate

Systemtic Name: prop-2-enyl N-[2-[[6-(2-pyridin-2-ylsulfanylethanoylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate Openeye Name: allyl N-[2-[[6-[[2-(2-pyridylsulfanyl)acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate CAS Name: N-[2-[[6-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]-1,3-benzothiazol-2-yl]thio]ethyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[2-[[6-[(2-pyridin-2-ylsulfanylacetyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate Traditional Name: N-[2-[[6-[[2-(2-pyridylthio)acetyl]amino]-1,3-benzothiazol-2-yl]thio]ethyl]carbamic acid allyl ester Formula: C20H20N4O3S3 MolecularWeight: 460.5928

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

C=CCOC(=O)NCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C20H20N4O3S3/c1-2-10-27-19(26)22-9-11-28-20-24-15-7-6-14(12-16(15)30-20)23-17(25)13-29-18-5-3-4-8-21-18/h2-8,12H,1,9-11,13H2,(H,22,26)(H,23,25)