2-[(3R,5S)-4-[2-[(1R)-1-butoxyethyl]pyrimidin-4-yl]-3,5-dimethyl-piperazin-1-yl]-4,6-dimethyl-1,3,5-triazine

Systemtic Name: 2-[(3R,5S)-4-[2-[(1R)-1-butoxyethyl]pyrimidin-4-yl]-3,5-dimethyl-piperazin-1-yl]-4,6-dimethyl-1,3,5-triazine Openeye Name: 2-[(3R,5S)-4-[2-[(1R)-1-butoxyethyl]pyrimidin-4-yl]-3,5-dimethyl-piperazin-1-yl]-4,6-dimethyl-1,3,5-triazine CAS Name: 2-[(3R,5S)-4-[2-[(1R)-1-butoxyethyl]-4-pyrimidinyl]-3,5-dimethyl-1-piperazinyl]-4,6-dimethyl-1,3,5-triazine IUPAC Name: 2-[(3R,5S)-4-[2-[(1R)-1-butoxyethyl]pyrimidin-4-yl]-3,5-dimethylpiperazin-1-yl]-4,6-dimethyl-1,3,5-triazine Traditional Name: 2-[(3R,5S)-4-[2-[(1R)-1-butoxyethyl]pyrimidin-4-yl]-3,5-dimethyl-piperazino]-4,6-dimethyl-s-triazine Formula: C21H33N7O MolecularWeight: 399.53302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)C1=NC=CC(=N1)N2C(CN(CC2C)C3=NC(=NC(=N3)C)C)C

Isomeric SMILES

CCCCO[C@H](C)C1=NC=CC(=N1)N2[C@@H](CN(C[C@@H]2C)C3=NC(=NC(=N3)C)C)C

InChI

InChI=1S/C21H33N7O/c1-7-8-11-29-16(4)20-22-10-9-19(26-20)28-14(2)12-27(13-15(28)3)21-24-17(5)23-18(6)25-21/h9-10,14-16H,7-8,11-13H2,1-6H3/t14-,15+,16-/m1/s1