3-cyclohexyl-N-(2,3-dihydro-1H-inden-5-ylmethyl)-2-[[2-(ethylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]propanamide

Systemtic Name: 3-cyclohexyl-N-(2,3-dihydro-1H-inden-5-ylmethyl)-2-[[2-(ethylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]propanamide Openeye Name: 3-cyclohexyl-2-[[2-(ethylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]-N-(indan-5-ylmethyl)propanamide CAS Name: 3-cyclohexyl-N-(2,3-dihydro-1H-inden-5-ylmethyl)-2-[[2-(ethylamino)-6-(1-pyrrolyl)-4-pyrimidinyl]amino]propanamide IUPAC Name: 3-cyclohexyl-N-(2,3-dihydro-1H-inden-5-ylmethyl)-2-[[2-(ethylamino)-6-pyrrol-1-ylpyrimidin-4-yl]amino]propanamide Traditional Name: 3-cyclohexyl-2-[[2-(ethylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]-N-(indan-5-ylmethyl)propionamide Formula: C29H38N6O MolecularWeight: 486.65162

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=CC(=N1)NC(CC2CCCCC2)C(=O)NCC3=CC4=C(CCC4)C=C3)N5C=CC=C5

Isomeric SMILES

CCNC1=NC(=CC(=N1)NC(CC2CCCCC2)C(=O)NCC3=CC4=C(CCC4)C=C3)N5C=CC=C5

InChI

InChI=1S/C29H38N6O/c1-2-30-29-33-26(19-27(34-29)35-15-6-7-16-35)32-25(18-21-9-4-3-5-10-21)28(36)31-20-22-13-14-23-11-8-12-24(23)17-22/h6-7,13-17,19,21,25H,2-5,8-12,18,20H2,1H3,(H,31,36)(H2,30,32,33,34)