N-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)-3-methylsulfanyl-2-aza-4-azoniaspiro[4.5]deca-1,3-dien-1-amine

Systemtic Name: N-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)-3-methylsulfanyl-2-aza-4-azoniaspiro[4.5]deca-1,3-dien-1-amine Openeye Name: N-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)-3-methylsulfanyl-2-aza-4-azoniaspiro[4.5]deca-1,3-dien-1-amine CAS Name: N-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)-3-(methylthio)-2-aza-4-azoniaspiro[4.5]deca-1,3-dien-1-amine IUPAC Name: N-(2,6-dimethylphenyl)-4-(4-methoxyphenyl)-3-methylsulfanyl-2-aza-4-azoniaspiro[4.5]deca-1,3-dien-1-amine Traditional Name: (2,6-dimethylphenyl)-[4-(4-methoxyphenyl)-3-(methylthio)-2-aza-4-azoniaspiro[4.5]deca-1,3-dien-1-yl]amine Formula: C24H30N3OS+ MolecularWeight: 408.5795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NC(=[N+](C23CCCCC3)C4=CC=C(C=C4)OC)SC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NC(=[N+](C23CCCCC3)C4=CC=C(C=C4)OC)SC

InChI

InChI=1S/C24H29N3OS/c1-17-9-8-10-18(2)21(17)25-22-24(15-6-5-7-16-24)27(23(26-22)29-4)19-11-13-20(28-3)14-12-19/h8-14H,5-7,15-16H2,1-4H3/p+1