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

Systemtic Name: 4-(1-benzothiophen-2-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 4-(benzothiophen-2-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline CAS Name: 4-(1-benzothiophen-2-yl)-2-methyl-7-(2-pyrimidinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 4-(1-benzothiophen-2-yl)-2-methyl-7-pyrimidin-2-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 4-(benzothiophen-2-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=CC=CC=C5S4

Isomeric SMILES

CN1CC(C2=C(C1)C=C(C=C2)C3=NC=CC=N3)C4=CC5=CC=CC=C5S4

InChI

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