methyl N-cyclohexyl-N'-(10-methylacridin-10-ium-9-yl)-N-propan-2-yl-carbamimidothioate

Systemtic Name: methyl N-cyclohexyl-N'-(10-methylacridin-10-ium-9-yl)-N-propan-2-yl-carbamimidothioate Openeye Name: 1-cyclohexyl-1-isopropyl-2-methyl-3-(10-methylacridin-10-ium-9-yl)isothiourea CAS Name: N-cyclohexyl-N'-(10-methyl-9-acridin-10-iumyl)-N-propan-2-ylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-cyclohexyl-N'-(10-methylacridin-10-ium-9-yl)-N-propan-2-ylcarbamimidothioate Traditional Name: 1-cyclohexyl-1-isopropyl-2-methyl-3-(10-methylacridin-10-ium-9-yl)isothiourea Formula: C25H32N3S+ MolecularWeight: 406.60668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1CCCCC1)C(=NC2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C)SC

Isomeric SMILES

CC(C)N(C1CCCCC1)C(=NC2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C)SC

InChI

InChI=1S/C25H32N3S/c1-18(2)28(19-12-6-5-7-13-19)25(29-4)26-24-20-14-8-10-16-22(20)27(3)23-17-11-9-15-21(23)24/h8-11,14-19H,5-7,12-13H2,1-4H3/q+1