N-(furan-2-ylmethyl)-2-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide Openeye Name: N-(2-furylmethyl)-2-[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]phenyl]sulfanyl-acetamide CAS Name: N-(2-furanylmethyl)-2-[[2-[[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-oxomethyl]phenyl]thio]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-[2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: N-(2-furfuryl)-2-[[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]phenyl]thio]acetamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C26H31N5O3S/c1-18(2)25-28-19(3)15-23(29-25)30-10-12-31(13-11-30)26(33)21-8-4-5-9-22(21)35-17-24(32)27-16-20-7-6-14-34-20/h4-9,14-15,18H,10-13,16-17H2,1-3H3,(H,27,32)