(3S)-N-(4-propan-2-ylphenyl)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine

Systemtic Name: (3S)-N-(4-propan-2-ylphenyl)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine Openeye Name: (3S)-N-(4-isopropylphenyl)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine CAS Name: (3S)-N-(4-propan-2-ylphenyl)-1-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-3-piperidinamine IUPAC Name: (3S)-N-(4-propan-2-ylphenyl)-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine Traditional Name: p-cumenyl-[(3S)-1-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]-3-piperidyl]amine Formula: C23H29N5 MolecularWeight: 375.50986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)CC3=CC=CN3C4=NC=CC=N4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N[C@H]2CCCN(C2)CC3=CC=CN3C4=NC=CC=N4

InChI

InChI=1S/C23H29N5/c1-18(2)19-8-10-20(11-9-19)26-21-6-3-14-27(16-21)17-22-7-4-15-28(22)23-24-12-5-13-25-23/h4-5,7-13,15,18,21,26H,3,6,14,16-17H2,1-2H3/t21-/m0/s1