N-(cyclopropylmethyl)-4-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3CC3)N(CC)CC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3CC3)N(CC)CC

InChI

InChI=1S/C22H30N4OS/c1-4-19-13-20(26(5-2)6-3)25-22(24-19)28-15-17-9-11-18(12-10-17)21(27)23-14-16-7-8-16/h9-13,16H,4-8,14-15H2,1-3H3,(H,23,27)