prop-2-enyl N-[2-[[6-(hex-5-ynoylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate

Systemtic Name: prop-2-enyl N-[2-[[6-(hex-5-ynoylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate Openeye Name: allyl N-[2-[[6-(hex-5-ynoylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate CAS Name: N-[2-[[6-(1-oxohex-5-ynylamino)-1,3-benzothiazol-2-yl]thio]ethyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[2-[[6-(hex-5-ynoylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate Traditional Name: N-[2-[[6-(hex-5-ynoylamino)-1,3-benzothiazol-2-yl]thio]ethyl]carbamic acid allyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCC#C

Isomeric SMILES

C=CCOC(=O)NCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCC#C

InChI

InChI=1S/C19H21N3O3S2/c1-3-5-6-7-17(23)21-14-8-9-15-16(13-14)27-19(22-15)26-12-10-20-18(24)25-11-4-2/h1,4,8-9,13H,2,5-7,10-12H2,(H,20,24)(H,21,23)