1-(1,3-benzodioxol-5-yl)-2-[5-[5-(4-methoxyphenyl)pyrimidin-2-yl]pyrimidin-2-yl]-3,9-dihydro-1H-pyrido[3,4-b]indol-4-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-[5-[5-(4-methoxyphenyl)pyrimidin-2-yl]pyrimidin-2-yl]-3,9-dihydro-1H-pyrido[3,4-b]indol-4-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-[5-[5-(4-methoxyphenyl)pyrimidin-2-yl]pyrimidin-2-yl]-3,9-dihydro-1H-pyrido[3,4-b]indol-4-one CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[5-[5-(4-methoxyphenyl)-2-pyrimidinyl]-2-pyrimidinyl]-3,9-dihydro-1H-pyrido[3,4-b]indol-4-one IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-[5-[5-(4-methoxyphenyl)pyrimidin-2-yl]pyrimidin-2-yl]-3,9-dihydro-1H-pyrido[3,4-b]indol-4-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[5-[5-(4-methoxyphenyl)pyrimidin-2-yl]pyrimidin-2-yl]-3,9-dihydro-1H-$b-carbolin-4-one Formula: C33H24N6O4 MolecularWeight: 568.58146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CN=C(N=C3)N4CC(=O)C5=C(C4C6=CC7=C(C=C6)OCO7)NC8=CC=CC=C85

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CN=C(N=C3)N4CC(=O)C5=C(C4C6=CC7=C(C=C6)OCO7)NC8=CC=CC=C85

InChI

InChI=1S/C33H24N6O4/c1-41-23-9-6-19(7-10-23)21-13-34-32(35-14-21)22-15-36-33(37-16-22)39-17-26(40)29-24-4-2-3-5-25(24)38-30(29)31(39)20-8-11-27-28(12-20)43-18-42-27/h2-16,31,38H,17-18H2,1H3