4-azanyl-2-(triphenylmethyl)sulfanyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-azanyl-2-(triphenylmethyl)sulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 4-amino-2-tritylsulfanyl-pyrimidine-5-carboxylic acid CAS Name: 4-amino-2-[(triphenylmethyl)thio]-5-pyrimidinecarboxylic acid IUPAC Name: 4-amino-2-tritylsulfanylpyrimidine-5-carboxylic acid Traditional Name: 4-amino-2-(tritylthio)pyrimidine-5-carboxylic acid Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SC4=NC=C(C(=N4)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SC4=NC=C(C(=N4)N)C(=O)O

InChI

InChI=1S/C24H19N3O2S/c25-21-20(22(28)29)16-26-23(27-21)30-24(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H,(H,28,29)(H2,25,26,27)