4-[[(1R)-2-methyl-1-thiophen-2-yl-propyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[[(1R)-2-methyl-1-thiophen-2-yl-propyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: 4-[[(1R)-2-methyl-1-(2-thienyl)propyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[[(1R)-2-methyl-1-thiophen-2-ylpropyl]iminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[[(1R)-2-methyl-1-thiophen-2-ylpropyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: 4-[[(1R)-2-methyl-1-(2-thienyl)propyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)N=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)N=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C23H21N3O2S/c1-15(2)21(19-10-7-13-29-19)25-14-18-16-8-3-4-9-17(16)22(27)26(23(18)28)20-11-5-6-12-24-20/h3-15,18,21H,1-2H3/t18?,21-/m1/s1