6-methoxy-1,3-benzothiazole; 6-methyl-2-(methylamino)-5-octyl-1,3-diazinan-4-one

Systemtic Name: 6-methoxy-1,3-benzothiazole; 6-methyl-2-(methylamino)-5-octyl-1,3-diazinan-4-one Openeye Name: 6-methoxy-1,3-benzothiazole; 6-methyl-2-(methylamino)-5-octyl-hexahydropyrimidin-4-one CAS Name: 6-methoxy-1,3-benzothiazole; 6-methyl-2-(methylamino)-5-octyl-1,3-diazinan-4-one IUPAC Name: 6-methoxy-1,3-benzothiazole; 6-methyl-2-(methylamino)-5-octyl-1,3-diazinan-4-one Traditional Name: 6-methoxy-1,3-benzothiazole; 6-methyl-2-(methylamino)-5-octyl-hexahydropyrimidin-4-one Formula: C22H36N4O2S MolecularWeight: 420.61184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(NC(NC1=O)NC)C.COC1=CC2=C(C=C1)N=CS2

Isomeric SMILES

CCCCCCCCC1C(NC(NC1=O)NC)C.COC1=CC2=C(C=C1)N=CS2

InChI

InChI=1S/C14H29N3O.C8H7NOS/c1-4-5-6-7-8-9-10-12-11(2)16-14(15-3)17-13(12)18;1-10-6-2-3-7-8(4-6)11-5-9-7/h11-12,14-16H,4-10H2,1-3H3,(H,17,18);2-5H,1H3