4-[[4-(2-methoxyethyl)-4-(methoxymethyl)-6-methyl-3-oxidanylidene-pyrazin-4-ium-2-yl]amino]-3,5-dimethyl-thiobenzaldehyde

Systemtic Name: 4-[[4-(2-methoxyethyl)-4-(methoxymethyl)-6-methyl-3-oxidanylidene-pyrazin-4-ium-2-yl]amino]-3,5-dimethyl-thiobenzaldehyde Openeye Name: 4-[[4-(2-methoxyethyl)-4-(methoxymethyl)-6-methyl-3-oxo-pyrazin-4-ium-2-yl]amino]-3,5-dimethyl-thiobenzaldehyde CAS Name: 4-[[4-(2-methoxyethyl)-4-(methoxymethyl)-6-methyl-3-oxo-2-pyrazin-4-iumyl]amino]-3,5-dimethylthiobenzaldehyde IUPAC Name: 4-[[4-(2-methoxyethyl)-4-(methoxymethyl)-6-methyl-3-oxopyrazin-4-ium-2-yl]amino]-3,5-dimethylthiobenzaldehyde Traditional Name: 4-[[3-keto-4-(2-methoxyethyl)-4-(methoxymethyl)-6-methyl-pyrazin-4-ium-2-yl]amino]-3,5-dimethyl-thiobenzaldehyde Formula: C19H26N3O3S+ MolecularWeight: 376.49304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC(=C[N+](C2=O)(CCOC)COC)C)C)C=S

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC(=C[N+](C2=O)(CCOC)COC)C)C)C=S

InChI

InChI=1S/C19H25N3O3S/c1-13-8-16(11-26)9-14(2)17(13)21-18-19(23)22(12-25-5,6-7-24-4)10-15(3)20-18/h8-11H,6-7,12H2,1-5H3/p+1