2-azanylethyl N'-[(4Z)-3-oxidanylidene-4-[(4-propanoylphenyl)hydrazinylidene]cyclohexa-1,5-dien-1-yl]carbamimidothioate

Systemtic Name: 2-azanylethyl N'-[(4Z)-3-oxidanylidene-4-[(4-propanoylphenyl)hydrazinylidene]cyclohexa-1,5-dien-1-yl]carbamimidothioate Openeye Name: 2-(2-aminoethyl)-3-[(4Z)-3-oxo-4-[(4-propanoylphenyl)hydrazono]cyclohexa-1,5-dien-1-yl]isothiourea CAS Name: N'-[(4Z)-3-oxo-4-[[4-(1-oxopropyl)phenyl]hydrazinylidene]-1-cyclohexa-1,5-dienyl]carbamimidothioic acid 2-aminoethyl ester IUPAC Name: 2-aminoethyl N'-[(4Z)-3-oxo-4-[(4-propanoylphenyl)hydrazinylidene]cyclohexa-1,5-dien-1-yl]carbamimidothioate Traditional Name: 2-(2-aminoethyl)-3-[(4Z)-3-keto-4-[(4-propionylphenyl)hydrazono]cyclohexa-1,5-dien-1-yl]isothiourea Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)NN=C2C=CC(=CC2=O)N=C(N)SCCN

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)N/N=C\2/C=CC(=CC2=O)N=C(N)SCCN

InChI

InChI=1S/C18H21N5O2S/c1-2-16(24)12-3-5-13(6-4-12)22-23-15-8-7-14(11-17(15)25)21-18(20)26-10-9-19/h3-8,11,22H,2,9-10,19H2,1H3,(H2,20,21)/b23-15-