5-(3,4-dimethoxyphenyl)-2-ethylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-ethylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine Openeye Name: 5-(3,4-dimethoxyphenyl)-2-ethylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine CAS Name: 5-(3,4-dimethoxyphenyl)-2-(ethylthio)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-ethylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine Traditional Name: [5-(3,4-dimethoxyphenyl)-2-(ethylthio)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-yl]amine Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=NC3=C(CCCC3)C(=C2C(=N1)N)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCSC1=NC2=NC3=C(CCCC3)C(=C2C(=N1)N)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C21H24N4O2S/c1-4-28-21-24-19(22)18-17(12-9-10-15(26-2)16(11-12)27-3)13-7-5-6-8-14(13)23-20(18)25-21/h9-11H,4-8H2,1-3H3,(H2,22,23,24,25)