3-[2-(3-methoxyphenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(3-methoxyphenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-(3-methoxyphenyl)-4-thioxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-(3-methoxyphenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-dimethylammonium IUPAC Name: 3-[2-(3-methoxyphenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-dimethylazanium Traditional Name: 3-[2-(3-methoxyphenyl)-4-thioxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-dimethyl-ammonium Formula: C20H28N3OS+ MolecularWeight: 358.52082

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C2=C(CCCC2)C(=S)N=C1C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+](C)CCCN1C2=C(CCCC2)C(=S)N=C1C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H27N3OS/c1-22(2)12-7-13-23-18-11-5-4-10-17(18)20(25)21-19(23)15-8-6-9-16(14-15)24-3/h6,8-9,14H,4-5,7,10-13H2,1-3H3/p+1