4-[3-[(Z)-(carbamothioylhydrazinylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate

Systemtic Name: 4-[3-[(Z)-(carbamothioylhydrazinylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: 4-[3-[(Z)-(carbamothioylhydrazono)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 4-[3-[(Z)-(carbamothioylhydrazinylidene)methyl]-2,5-dimethyl-1-pyrrolyl]benzoate IUPAC Name: 4-[3-[(Z)-(carbamothioylhydrazinylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 4-[2,5-dimethyl-3-[(Z)-(thiocarbamoylhydrazono)methyl]pyrrol-1-yl]benzoate Formula: C15H15N4O2S- MolecularWeight: 315.3702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)[O-])C)C=NNC(=S)N

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)[O-])C)/C=N\NC(=S)N

InChI

InChI=1S/C15H16N4O2S/c1-9-7-12(8-17-18-15(16)22)10(2)19(9)13-5-3-11(4-6-13)14(20)21/h3-8H,1-2H3,(H,20,21)(H3,16,18,22)/p-1/b17-8-