methyl 2-cyclopropyl-4-methyl-6-[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-cyclopropyl-4-methyl-6-[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: methyl 2-cyclopropyl-4-methyl-6-[2-oxo-2-(tetralin-1-ylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 2-cyclopropyl-4-methyl-6-[[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]thio]-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-cyclopropyl-4-methyl-6-[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 2-cyclopropyl-4-[[2-keto-2-(tetralin-1-ylamino)ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3CCCC4=CC=CC=C34)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3CCCC4=CC=CC=C34)C(=O)OC

InChI

InChI=1S/C22H25N3O3S/c1-13-19(22(27)28-2)21(25-20(23-13)15-10-11-15)29-12-18(26)24-17-9-5-7-14-6-3-4-8-16(14)17/h3-4,6,8,15,17H,5,7,9-12H2,1-2H3,(H,24,26)