N-[5-azanyl-6-(phenylmethylsulfanyl)pyrimidin-4-yl]-4-chloranyl-benzamide

Systemtic Name: N-[5-azanyl-6-(phenylmethylsulfanyl)pyrimidin-4-yl]-4-chloranyl-benzamide Openeye Name: N-(5-amino-6-benzylsulfanyl-pyrimidin-4-yl)-4-chloro-benzamide CAS Name: N-[5-amino-6-(phenylmethylthio)-4-pyrimidinyl]-4-chlorobenzamide IUPAC Name: N-(5-amino-6-benzylsulfanylpyrimidin-4-yl)-4-chlorobenzamide Traditional Name: N-[5-amino-6-(benzylthio)pyrimidin-4-yl]-4-chloro-benzamide Formula: C18H15ClN4OS MolecularWeight: 370.8559

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=NC(=C2N)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=NC(=C2N)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN4OS/c19-14-8-6-13(7-9-14)17(24)23-16-15(20)18(22-11-21-16)25-10-12-4-2-1-3-5-12/h1-9,11H,10,20H2,(H,21,22,23,24)