N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-3-methylsulfanyl-propanamide Openeye Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-3-methylsulfanyl-propanamide CAS Name: N-[1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-3-(methylthio)propanamide IUPAC Name: N-[1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]-3-methylsulfanylpropanamide Traditional Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-3-(methylthio)propionamide Formula: C18H30N4OS MolecularWeight: 350.522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)CCSC)N2CCCCCCC2

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)CCSC)N2CCCCCCC2

InChI

InChI=1S/C18H30N4OS/c1-14(20-17(23)9-12-24-3)16-13-19-18(21-15(16)2)22-10-7-5-4-6-8-11-22/h13-14H,4-12H2,1-3H3,(H,20,23)