3-[2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanylethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 3-[2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 3-[[2-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: 3-[[2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[2-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]acetyl]amino]-N-cyclopropyl-benzamide Formula: C24H24ClN5O2S MolecularWeight: 481.99766

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H24ClN5O2S/c1-2-19-21(14-6-8-16(25)9-7-14)22(26)30-24(29-19)33-13-20(31)27-18-5-3-4-15(12-18)23(32)28-17-10-11-17/h3-9,12,17H,2,10-11,13H2,1H3,(H,27,31)(H,28,32)(H2,26,29,30)