5,6-bis(azanyl)-2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5,6-bis(azanyl)-2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 5,6-diamino-2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 5,6-diamino-2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 5,6-diamino-2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 5,6-diamino-2-[(2-indolin-1-yl-2-keto-ethyl)thio]-1H-pyrimidin-4-one Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)CSC3=NC(=O)C(=C(N3)N)N

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)CSC3=NC(=O)C(=C(N3)N)N

InChI

InChI=1S/C14H15N5O2S/c15-11-12(16)17-14(18-13(11)21)22-7-10(20)19-6-5-8-3-1-2-4-9(8)19/h1-4H,5-7,15H2,(H3,16,17,18,21)