N-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C24H28N5O2S+ MolecularWeight: 450.57642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H27N5O2S/c1-16(2)22-25-17(3)15-21(27-22)28-10-12-29(13-11-28)24(31)18-7-4-5-8-19(18)26-23(30)20-9-6-14-32-20/h4-9,14-16H,10-13H2,1-3H3,(H,26,30)/p+1