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

Systemtic Name: 4-propyl-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione Openeye Name: 4-propyl-9-(2-thienyl)-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione CAS Name: 4-propyl-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione IUPAC Name: 4-propyl-9-thiophen-2-yl-9,10-dihydro-8H-pyrimido[4,5-c]isoquinoline-1,3,7-trione Traditional Name: 4-propyl-9-(2-thienyl)-9,10-dihydro-8H-pyrimid[4,5-c]isoquinoline-1,3,7-trione Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC=C3C(=C2C(=O)NC1=O)CC(CC3=O)C4=CC=CS4

Isomeric SMILES

CCCN1C2=NC=C3C(=C2C(=O)NC1=O)CC(CC3=O)C4=CC=CS4

InChI

InChI=1S/C18H17N3O3S/c1-2-5-21-16-15(17(23)20-18(21)24)11-7-10(14-4-3-6-25-14)8-13(22)12(11)9-19-16/h3-4,6,9-10H,2,5,7-8H2,1H3,(H,20,23,24)