N-(cyclopropylmethyl)-3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(cyclopropylmethyl)-3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-(cyclopropylmethyl)-3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-(cyclopropylmethyl)-3-[[[4-ethyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-(cyclopropylmethyl)-3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-(cyclopropylmethyl)-3-[[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]benzamide Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)CC)SCC2=CC=CC(=C2)C(=O)NCC3CC3

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)CC)SCC2=CC=CC(=C2)C(=O)NCC3CC3

InChI

InChI=1S/C22H30N4OS/c1-4-11-26(3)20-13-19(5-2)24-22(25-20)28-15-17-7-6-8-18(12-17)21(27)23-14-16-9-10-16/h6-8,12-13,16H,4-5,9-11,14-15H2,1-3H3,(H,23,27)