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

Systemtic Name: N-cyclopropyl-3-[[4-[methyl(propyl)amino]-6-propan-2-yl-pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-3-[[4-isopropyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-3-[[[4-[methyl(propyl)amino]-6-propan-2-yl-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-3-[[4-[methyl(propyl)amino]-6-propan-2-ylpyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-3-[[[4-isopropyl-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)C(C)C)SCC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)C(C)C)SCC2=CC=CC(=C2)C(=O)NC3CC3

InChI

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