N-[4-(4-chloranyl-2-cyclohexyl-phenoxy)phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[4-(4-chloranyl-2-cyclohexyl-phenoxy)phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide Openeye Name: N-[4-(4-chloro-2-cyclohexyl-phenoxy)phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide CAS Name: N-[4-(4-chloro-2-cyclohexylphenoxy)phenyl]-3-[(2-pyrazinylthio)methyl]benzamide IUPAC Name: N-[4-(4-chloro-2-cyclohexylphenoxy)phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide Traditional Name: N-[4-(4-chloro-2-cyclohexyl-phenoxy)phenyl]-3-[(pyrazin-2-ylthio)methyl]benzamide Formula: C30H28ClN3O2S MolecularWeight: 530.08022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)CSC5=NC=CN=C5

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)CSC5=NC=CN=C5

InChI

InChI=1S/C30H28ClN3O2S/c31-24-9-14-28(27(18-24)22-6-2-1-3-7-22)36-26-12-10-25(11-13-26)34-30(35)23-8-4-5-21(17-23)20-37-29-19-32-15-16-33-29/h4-5,8-19,22H,1-3,6-7,20H2,(H,34,35)