4-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-2-(phenylmethylsulfanyl)pyrimidine

Systemtic Name: 4-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-2-(phenylmethylsulfanyl)pyrimidine Openeye Name: 2-benzylsulfanyl-4-(5-chloro-3-methyl-benzothiophen-2-yl)pyrimidine CAS Name: 4-(5-chloro-3-methyl-1-benzothiophen-2-yl)-2-(phenylmethylthio)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-(5-chloro-3-methyl-1-benzothiophen-2-yl)pyrimidine Traditional Name: 2-(benzylthio)-4-(5-chloro-3-methyl-benzothiophen-2-yl)pyrimidine Formula: C20H15ClN2S2 MolecularWeight: 382.9295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C3=NC(=NC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C3=NC(=NC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C20H15ClN2S2/c1-13-16-11-15(21)7-8-18(16)25-19(13)17-9-10-22-20(23-17)24-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3