methyl 1-[2-[(4-oxidanylcyclohexyl)amino]-1H-pyrimidin-2-yl]indole-6-carboxylate

Systemtic Name: methyl 1-[2-[(4-oxidanylcyclohexyl)amino]-1H-pyrimidin-2-yl]indole-6-carboxylate Openeye Name: methyl 1-[2-[(4-hydroxycyclohexyl)amino]-1H-pyrimidin-2-yl]indole-6-carboxylate CAS Name: 1-[2-[(4-hydroxycyclohexyl)amino]-1H-pyrimidin-2-yl]-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-hydroxycyclohexyl)amino]-1H-pyrimidin-2-yl]indole-6-carboxylate Traditional Name: 1-[2-[(4-hydroxycyclohexyl)amino]-1H-pyrimidin-2-yl]indole-6-carboxylic acid methyl ester Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C=CN2C3(NC=CC=N3)NC4CCC(CC4)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C=CN2C3(NC=CC=N3)NC4CCC(CC4)O

InChI

InChI=1S/C20H24N4O3/c1-27-19(26)15-4-3-14-9-12-24(18(14)13-15)20(21-10-2-11-22-20)23-16-5-7-17(25)8-6-16/h2-4,9-13,16-17,21,23,25H,5-8H2,1H3