6-azanyl-2-[2-(1-methyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-(1-methyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(1-methyl-2-phenyl-indol-3-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(1-methyl-2-phenyl-3-indolyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(1-methyl-2-phenylindol-3-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-keto-2-(1-methyl-2-phenyl-indol-3-yl)ethyl]thio]-1H-pyrimidin-4-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CSC4=NC(=O)C=C(N4)N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CSC4=NC(=O)C=C(N4)N

InChI

InChI=1S/C21H18N4O2S/c1-25-15-10-6-5-9-14(15)19(20(25)13-7-3-2-4-8-13)16(26)12-28-21-23-17(22)11-18(27)24-21/h2-11H,12H2,1H3,(H3,22,23,24,27)