prop-2-enyl N-[2-[[6-[(2-fluoranyl-4-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate

Systemtic Name: prop-2-enyl N-[2-[[6-[(2-fluoranyl-4-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate Openeye Name: allyl N-[2-[[6-[(2-fluoro-4-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate CAS Name: N-[2-[[6-[[(2-fluoro-4-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]thio]ethyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[2-[[6-[(2-fluoro-4-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl]carbamate Traditional Name: N-[2-[[6-[(2-fluoro-4-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]thio]ethyl]carbamic acid allyl ester Formula: C20H17FN4O5S2 MolecularWeight: 476.501183

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C=CCOC(=O)NCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C20H17FN4O5S2/c1-2-8-30-19(27)22-7-9-31-20-24-16-6-3-12(10-17(16)32-20)23-18(26)14-5-4-13(25(28)29)11-15(14)21/h2-6,10-11H,1,7-9H2,(H,22,27)(H,23,26)