dimethyl-[(3S)-1-[4-[1-(3-methylphenyl)pyrazol-4-yl]pyrimidin-2-yl]pyrrolidin-3-yl]azanium

Systemtic Name: dimethyl-[(3S)-1-[4-[1-(3-methylphenyl)pyrazol-4-yl]pyrimidin-2-yl]pyrrolidin-3-yl]azanium Openeye Name: dimethyl-[(3S)-1-[4-[1-(m-tolyl)pyrazol-4-yl]pyrimidin-2-yl]pyrrolidin-3-yl]ammonium CAS Name: dimethyl-[(3S)-1-[4-[1-(3-methylphenyl)-4-pyrazolyl]-2-pyrimidinyl]-3-pyrrolidinyl]ammonium IUPAC Name: dimethyl-[(3S)-1-[4-[1-(3-methylphenyl)pyrazol-4-yl]pyrimidin-2-yl]pyrrolidin-3-yl]azanium Traditional Name: dimethyl-[(3S)-1-[4-[1-(m-tolyl)pyrazol-4-yl]pyrimidin-2-yl]pyrrolidin-3-yl]ammonium Formula: C20H25N6+ MolecularWeight: 349.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C=N2)C3=NC(=NC=C3)N4CCC(C4)[NH+](C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C=N2)C3=NC(=NC=C3)N4CC[C@@H](C4)[NH+](C)C

InChI

InChI=1S/C20H24N6/c1-15-5-4-6-17(11-15)26-13-16(12-22-26)19-7-9-21-20(23-19)25-10-8-18(14-25)24(2)3/h4-7,9,11-13,18H,8,10,14H2,1-3H3/p+1/t18-/m0/s1