4-methanoyl-N-[(1Z)-1-(1-oxidanylpyridin-2-ylidene)ethyl]imino-piperazine-1-carbothioamide

Systemtic Name: 4-methanoyl-N-[(1Z)-1-(1-oxidanylpyridin-2-ylidene)ethyl]imino-piperazine-1-carbothioamide Openeye Name: 4-formyl-N-[(1Z)-1-(1-hydroxy-2-pyridylidene)ethyl]imino-piperazine-1-carbothioamide CAS Name: 4-formyl-N-[(1Z)-1-(1-hydroxy-2-pyridinylidene)ethyl]imino-1-piperazinecarbothioamide IUPAC Name: 4-formyl-N-[(1Z)-1-(1-hydroxypyridin-2-ylidene)ethyl]iminopiperazine-1-carbothioamide Traditional Name: 4-formyl-N-[(1Z)-1-(1-hydroxy-2-pyridylidene)ethyl]imino-piperazine-1-carbothioamide Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC=CN1O)N=NC(=S)N2CCN(CC2)C=O

Isomeric SMILES

C/C(=C/1\C=CC=CN1O)/N=NC(=S)N2CCN(CC2)C=O

InChI

InChI=1S/C13H17N5O2S/c1-11(12-4-2-3-5-18(12)20)14-15-13(21)17-8-6-16(10-19)7-9-17/h2-5,10,20H,6-9H2,1H3/b12-11-,15-14?