4-[2-(3,4-dimethoxyphenyl)ethylamino]-6,7-dimethoxy-1H-quinazoline-2-thione

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6,7-dimethoxy-1H-quinazoline-2-thione Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6,7-dimethoxy-1H-quinazoline-2-thione CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6,7-dimethoxy-1H-quinazoline-2-thione IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6,7-dimethoxy-1H-quinazoline-2-thione Traditional Name: 4-(homoveratrylamino)-6,7-dimethoxy-1H-quinazoline-2-thione Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC(=S)NC3=CC(=C(C=C32)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC(=S)NC3=CC(=C(C=C32)OC)OC)OC

InChI

InChI=1S/C20H23N3O4S/c1-24-15-6-5-12(9-16(15)25-2)7-8-21-19-13-10-17(26-3)18(27-4)11-14(13)22-20(28)23-19/h5-6,9-11H,7-8H2,1-4H3,(H2,21,22,23,28)