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

Systemtic Name: [3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [3-[[[4-methyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [3-[[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]phenyl]-pyrrolidino-methanone Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4OS/c1-4-10-24(3)19-13-16(2)22-21(23-19)27-15-17-8-7-9-18(14-17)20(26)25-11-5-6-12-25/h7-9,13-14H,4-6,10-12,15H2,1-3H3