methyl (1Z)-N-[4-[(4-azidophenyl)amino]butylcarbamoyloxy]ethanimidothioate

Systemtic Name: methyl (1Z)-N-[4-[(4-azidophenyl)amino]butylcarbamoyloxy]ethanimidothioate Openeye Name: methyl (1Z)-N-[4-(4-azidoanilino)butylcarbamoyloxy]ethanimidothioate CAS Name: (1Z)-N-[[4-(4-azidoanilino)butylamino]-oxomethoxy]ethanimidothioic acid methyl ester IUPAC Name: methyl (1Z)-N-[4-(4-azidoanilino)butylcarbamoyloxy]ethanimidothioate Traditional Name: (1Z)-N-[4-(4-azidoanilino)butylcarbamoyloxy]thioacetimidic acid methyl ester Formula: C14H20N6O2S MolecularWeight: 336.4126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)NCCCCNC1=CC=C(C=C1)N=[N+]=[N-])SC

Isomeric SMILES

C/C(=N/OC(=O)NCCCCNC1=CC=C(C=C1)N=[N+]=[N-])/SC

InChI

InChI=1S/C14H20N6O2S/c1-11(23-2)19-22-14(21)17-10-4-3-9-16-12-5-7-13(8-6-12)18-20-15/h5-8,16H,3-4,9-10H2,1-2H3,(H,17,21)/b19-11-