2-[2-(1-ethyl-2-methyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[2-(1-ethyl-2-methyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-[2-(1-ethyl-2-methyl-indol-3-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 2-[[2-(1-ethyl-2-methyl-3-indolyl)-2-oxoethyl]thio]-1H-pyrimidin-6-one IUPAC Name: 2-[2-(1-ethyl-2-methylindol-3-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[[2-(1-ethyl-2-methyl-indol-3-yl)-2-keto-ethyl]thio]-1H-pyrimidin-6-one Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C(=O)CSC3=NC=CC(=O)N3)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C(=O)CSC3=NC=CC(=O)N3)C

InChI

InChI=1S/C17H17N3O2S/c1-3-20-11(2)16(12-6-4-5-7-13(12)20)14(21)10-23-17-18-9-8-15(22)19-17/h4-9H,3,10H2,1-2H3,(H,18,19,22)