4-(1-benzothiophen-5-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 4-(1-benzothiophen-5-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 4-(benzothiophen-5-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline CAS Name: 4-(1-benzothiophen-5-yl)-2-methyl-7-(2-pyrimidinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 4-(1-benzothiophen-5-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 4-(benzothiophen-5-yl)-2-methyl-7-(2-pyrimidyl)-3,4-dihydro-1H-isoquinoline Formula: C22H19N3S MolecularWeight: 357.47136

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2=C(C1)C=C(C=C2)C3=NC=CC=N3)C4=CC5=C(C=C4)SC=C5

Isomeric SMILES

CN1CC(C2=C(C1)C=C(C=C2)C3=NC=CC=N3)C4=CC5=C(C=C4)SC=C5

InChI

InChI=1S/C22H19N3S/c1-25-13-18-12-17(22-23-8-2-9-24-22)3-5-19(18)20(14-25)15-4-6-21-16(11-15)7-10-26-21/h2-12,20H,13-14H2,1H3