6-azanyl-5-[2-(4-tert-butylphenyl)sulfanylethanoyl]-1-cyclopropyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(4-tert-butylphenyl)sulfanylethanoyl]-1-cyclopropyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(4-tert-butylphenyl)sulfanylacetyl]-1-cyclopropyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(4-tert-butylphenyl)thio]-1-oxoethyl]-1-cyclopropylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(4-tert-butylphenyl)sulfanylacetyl]-1-cyclopropylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(4-tert-butylphenyl)thio]acetyl]-1-cyclopropyl-pyrimidine-2,4-quinone Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N

InChI

InChI=1S/C19H23N3O3S/c1-19(2,3)11-4-8-13(9-5-11)26-10-14(23)15-16(20)22(12-6-7-12)18(25)21-17(15)24/h4-5,8-9,12H,6-7,10,20H2,1-3H3,(H,21,24,25)