methyl N-(2-methyl-3-thianthren-5-ium-5-yl-butan-2-yl)ethanimidate

Systemtic Name: methyl N-(2-methyl-3-thianthren-5-ium-5-yl-butan-2-yl)ethanimidate Openeye Name: methyl N-(1,1-dimethyl-2-thianthren-5-ium-5-yl-propyl)ethanimidate CAS Name: N-[2-methyl-3-(5-thianthren-5-iumyl)butan-2-yl]ethanimidic acid methyl ester IUPAC Name: methyl N-(2-methyl-3-thianthren-5-ium-5-ylbutan-2-yl)ethanimidate Traditional Name: N-(1,1-dimethyl-2-thianthren-5-ium-5-yl-propyl)acetimidic acid methyl ester Formula: C20H24NOS2+ MolecularWeight: 358.54066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)N=C(C)OC)[S+]1C2=CC=CC=C2SC3=CC=CC=C31

Isomeric SMILES

CC(C(C)(C)N=C(C)OC)[S+]1C2=CC=CC=C2SC3=CC=CC=C31

InChI

InChI=1S/C20H24NOS2/c1-14(20(3,4)21-15(2)22-5)24-18-12-8-6-10-16(18)23-17-11-7-9-13-19(17)24/h6-14H,1-5H3/q+1