3-(3-methylbutyl)-2-propan-2-yl-thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-(3-methylbutyl)-2-propan-2-yl-thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-isopentyl-2-isopropyl-thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-(3-methylbutyl)-2-propan-2-ylthiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-(3-methylbutyl)-2-propan-2-ylthiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-isoamyl-2-isopropyl-thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(N=C1C(C)C)SC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(N=C1C(C)C)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H22N2O2S/c1-11(2)9-10-21-17(12(3)4)20-18-15(19(21)23)16(22)13-7-5-6-8-14(13)24-18/h5-8,11-12H,9-10H2,1-4H3