[4-[(E)-(carbamothioylhydrazinylidene)methyl]-3-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate

Systemtic Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-3-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate Openeye Name: [4-[(E)-(carbamothioylhydrazono)methyl]-3-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-[(E)-(carbamothioylhydrazinylidene)methyl]-3-(2-methyl-1-oxopropoxy)phenyl] ester IUPAC Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-3-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [3-isobutyryloxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=CC(=C(C=C1)C=NNC(=S)N)OC(=O)C(C)C

Isomeric SMILES

CC(C)C(=O)OC1=CC(=C(C=C1)/C=N/NC(=S)N)OC(=O)C(C)C

InChI

InChI=1S/C16H21N3O4S/c1-9(2)14(20)22-12-6-5-11(8-18-19-16(17)24)13(7-12)23-15(21)10(3)4/h5-10H,1-4H3,(H3,17,19,24)/b18-8+