[3-(2-chloranyl-5-ethylsulfanyl-3-phenyl-phenyl)-4-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methanamine

Systemtic Name: [3-(2-chloranyl-5-ethylsulfanyl-3-phenyl-phenyl)-4-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methanamine Openeye Name: [3-(2-chloro-5-ethylsulfanyl-3-phenyl-phenyl)-4-phenyl-4,5-dihydroisoxazol-5-yl]methanamine CAS Name: [3-[2-chloro-5-(ethylthio)-3-phenylphenyl]-4-phenyl-4,5-dihydroisoxazol-5-yl]methanamine IUPAC Name: [3-(2-chloro-5-ethylsulfanyl-3-phenylphenyl)-4-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methanamine Traditional Name: [3-[2-chloro-5-(ethylthio)-3-phenyl-phenyl]-4-phenyl-2-isoxazolin-5-yl]methylamine Formula: C24H23ClN2OS MolecularWeight: 422.97022

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=C(C(=C1)C2=CC=CC=C2)Cl)C3=NOC(C3C4=CC=CC=C4)CN

Isomeric SMILES

CCSC1=CC(=C(C(=C1)C2=CC=CC=C2)Cl)C3=NOC(C3C4=CC=CC=C4)CN

InChI

InChI=1S/C24H23ClN2OS/c1-2-29-18-13-19(16-9-5-3-6-10-16)23(25)20(14-18)24-22(21(15-26)28-27-24)17-11-7-4-8-12-17/h3-14,21-22H,2,15,26H2,1H3