methyl-[[6-oxidanylidene-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]-(1,3-thiazol-4-ylmethyl)azanium

Systemtic Name: methyl-[[6-oxidanylidene-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]-(1,3-thiazol-4-ylmethyl)azanium Openeye Name: methyl-[[6-oxo-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]-(thiazol-4-ylmethyl)ammonium CAS Name: methyl-[[6-oxo-3-(1H-pyridin-2-ylidene)-1-cyclohexa-1,4-dienyl]methyl]-(4-thiazolylmethyl)ammonium IUPAC Name: methyl-[[6-oxo-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]-(1,3-thiazol-4-ylmethyl)azanium Traditional Name: [6-keto-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl-methyl-(thiazol-4-ylmethyl)ammonium Formula: C17H18N3OS+ MolecularWeight: 312.40932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C2C=CC=CN2)C=CC1=O)CC3=CSC=N3

Isomeric SMILES

C[NH+](CC1=CC(=C2C=CC=CN2)C=CC1=O)CC3=CSC=N3

InChI

InChI=1S/C17H17N3OS/c1-20(10-15-11-22-12-19-15)9-14-8-13(5-6-17(14)21)16-4-2-3-7-18-16/h2-8,11-12,18H,9-10H2,1H3/p+1