4-[3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-[3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-[3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-[3-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-[3-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-[3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-3-keto-propyl]benzenesulfonamide Formula: C21H29N5O3S MolecularWeight: 431.55166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H29N5O3S/c1-15(2)21-23-16(3)14-19(24-21)25-10-12-26(13-11-25)20(27)9-6-17-4-7-18(8-5-17)30(22,28)29/h4-5,7-8,14-15H,6,9-13H2,1-3H3,(H2,22,28,29)