[3-[[4-tert-butyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [3-[[4-tert-butyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [3-[[4-tert-butyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [3-[[[4-tert-butyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [3-[[4-tert-butyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [3-[[[4-tert-butyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]phenyl]-pyrrolidino-methanone Formula: C24H34N4OS MolecularWeight: 426.61796

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)C(C)(C)C)SCC2=CC=CC(=C2)C(=O)N3CCCC3

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)C(C)(C)C)SCC2=CC=CC(=C2)C(=O)N3CCCC3

InChI

InChI=1S/C24H34N4OS/c1-6-12-27(5)21-16-20(24(2,3)4)25-23(26-21)30-17-18-10-9-11-19(15-18)22(29)28-13-7-8-14-28/h9-11,15-16H,6-8,12-14,17H2,1-5H3