4-(3-methoxypropyl)-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione

Systemtic Name: 4-(3-methoxypropyl)-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione Openeye Name: 4-(3-methoxypropyl)-9-(2-thienyl)-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione CAS Name: 4-(3-methoxypropyl)-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione IUPAC Name: 4-(3-methoxypropyl)-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione Traditional Name: 4-(3-methoxypropyl)-9-(2-thienyl)-9,10-dihydro-8H-pyrimid[4,5-c]isoquinoline-1,3,7-trione Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C2=NC=C3C(=C2C(=O)NC1=O)CC(CC3=O)C4=CC=CS4

Isomeric SMILES

COCCCN1C2=NC=C3C(=C2C(=O)NC1=O)CC(CC3=O)C4=CC=CS4

InChI

InChI=1S/C19H19N3O4S/c1-26-6-3-5-22-17-16(18(24)21-19(22)25)12-8-11(15-4-2-7-27-15)9-14(23)13(12)10-20-17/h2,4,7,10-11H,3,5-6,8-9H2,1H3,(H,21,24,25)