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

Systemtic Name: 2-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 2-[[2-(1,2-dimethyl-3-indolyl)-2-oxoethyl]thio]-1H-pyrimidin-6-one IUPAC Name: 2-[2-(1,2-dimethylindol-3-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[[2-(1,2-dimethylindol-3-yl)-2-keto-ethyl]thio]-1H-pyrimidin-6-one Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C(=O)CSC3=NC=CC(=O)N3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C(=O)CSC3=NC=CC(=O)N3

InChI

InChI=1S/C16H15N3O2S/c1-10-15(11-5-3-4-6-12(11)19(10)2)13(20)9-22-16-17-8-7-14(21)18-16/h3-8H,9H2,1-2H3,(H,17,18,21)