N-(3,4-dimethoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine hydrochloride

Systemtic Name: N-(3,4-dimethoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine hydrochloride Openeye Name: N-(3,4-dimethoxyphenyl)-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine hydrochloride CAS Name: N-(3,4-dimethoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine hydrochloride IUPAC Name: N-(3,4-dimethoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine hydrochloride Traditional Name: (3,4-dimethoxyphenyl)-(7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)amine hydrochloride Formula: C19H22ClN3O2S MolecularWeight: 391.91488

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=NC=NC(=C23)NC4=CC(=C(C=C4)OC)OC.Cl

Isomeric SMILES

CC1CCC2=C(C1)SC3=NC=NC(=C23)NC4=CC(=C(C=C4)OC)OC.Cl

InChI

InChI=1S/C19H21N3O2S.ClH/c1-11-4-6-13-16(8-11)25-19-17(13)18(20-10-21-19)22-12-5-7-14(23-2)15(9-12)24-3;/h5,7,9-11H,4,6,8H2,1-3H3,(H,20,21,22);1H