3-[(4-methoxyphenyl)-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanoyl]amino]propanamide

Systemtic Name: 3-[(4-methoxyphenyl)-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanoyl]amino]propanamide Openeye Name: 3-(N-[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]acetyl]-4-methoxy-anilino)propanamide CAS Name: 3-(4-methoxy-N-[2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]-1-oxoethyl]anilino)propanamide IUPAC Name: 3-(4-methoxy-N-[2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]acetyl]anilino)propanamide Traditional Name: 3-(N-[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]acetyl]-4-methoxy-anilino)propionamide Formula: C24H35N6O3+ MolecularWeight: 455.5731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)CC(=O)N(CCC(=O)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)CC(=O)N(CCC(=O)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H34N6O3/c1-17(2)24-26-18(3)15-22(27-24)29-13-11-28(12-14-29)16-23(32)30(10-9-21(25)31)19-5-7-20(33-4)8-6-19/h5-8,15,17H,9-14,16H2,1-4H3,(H2,25,31)/p+1