1-methyl-6-nonyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-1-ium

Systemtic Name: 1-methyl-6-nonyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-1-ium Openeye Name: 1-methyl-6-nonyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-1-ium CAS Name: 1-methyl-6-nonyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-1-ium IUPAC Name: 1-methyl-6-nonyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-1-ium Traditional Name: 1-methyl-6-nonyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-1-ium Formula: C20H31N2S+ MolecularWeight: 331.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C2C(=CC=C1)SC3=[N+](CCCN23)C

Isomeric SMILES

CCCCCCCCCC1=C2C(=CC=C1)SC3=[N+](CCCN23)C

InChI

InChI=1S/C20H31N2S/c1-3-4-5-6-7-8-9-12-17-13-10-14-18-19(17)22-16-11-15-21(2)20(22)23-18/h10,13-14H,3-9,11-12,15-16H2,1-2H3/q+1