4-azanyl-2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]thio]pyrimidine-5-carbonitrile Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H15N5OS/c1-8-4-11(9(2)19(8)3)12(20)7-21-14-17-6-10(5-15)13(16)18-14/h4,6H,7H2,1-3H3,(H2,16,17,18)