4-[2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[2-[(3-chlorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[2-[(3-chlorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]acetyl]amino]benzamide Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CSC2=NC(=O)C=C(N2)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CSC2=NC(=O)C=C(N2)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H17ClN4O3S/c21-14-3-1-2-12(8-14)11-29-20-24-16(10-18(27)25-20)9-17(26)23-15-6-4-13(5-7-15)19(22)28/h1-8,10H,9,11H2,(H2,22,28)(H,23,26)(H,24,25,27)