[4-(4-methoxyphenyl)-2-phenyl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [4-(4-methoxyphenyl)-2-phenyl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [4-(4-methoxyphenyl)-2-phenyl-5-thioxo-7H-pyrrolo[3,4-b]pyridin-6-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [4-(4-methoxyphenyl)-2-phenyl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [4-(4-methoxyphenyl)-2-phenyl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [4-(4-methoxyphenyl)-2-phenyl-5-thioxo-7H-pyrrolo[3,4-b]pyridin-6-yl]-(4-methylpiperazino)methanone Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)N2CC3=C(C2=S)C(=CC(=N3)C4=CC=CC=C4)C5=CC=C(C=C5)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)N2CC3=C(C2=S)C(=CC(=N3)C4=CC=CC=C4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C26H26N4O2S/c1-28-12-14-29(15-13-28)26(31)30-17-23-24(25(30)33)21(18-8-10-20(32-2)11-9-18)16-22(27-23)19-6-4-3-5-7-19/h3-11,16H,12-15,17H2,1-2H3