2-(3-methylphenyl)-4-[(5-morpholin-4-ylthiophen-2-yl)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3-methylphenyl)-4-[(5-morpholin-4-ylthiophen-2-yl)methylidene]isoquinoline-1,3-dione Openeye Name: 4-[(5-morpholino-2-thienyl)methylene]-2-(m-tolyl)isoquinoline-1,3-dione CAS Name: 2-(3-methylphenyl)-4-[[5-(4-morpholinyl)-2-thiophenyl]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3-methylphenyl)-4-[(5-morpholin-4-ylthiophen-2-yl)methylidene]isoquinoline-1,3-dione Traditional Name: 4-[(5-morpholino-2-thienyl)methylene]-2-(m-tolyl)isoquinoline-1,3-quinone Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC=C(S4)N5CCOCC5)C2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC=C(S4)N5CCOCC5)C2=O

InChI

InChI=1S/C25H22N2O3S/c1-17-5-4-6-18(15-17)27-24(28)21-8-3-2-7-20(21)22(25(27)29)16-19-9-10-23(31-19)26-11-13-30-14-12-26/h2-10,15-16H,11-14H2,1H3