N-cyclopropyl-3-[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-cyclopropyl-3-[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-3-[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-3-[[[4-(diethylamino)-5,6-dimethyl-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-3-[[4-(diethylamino)-5,6-dimethylpyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-3-[[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]thio]methyl]benzamide Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1C)C)SCC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1C)C)SCC2=CC=CC(=C2)C(=O)NC3CC3

InChI

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