N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]methyl]-3-chloranyl-aniline

Systemtic Name: N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]methyl]-3-chloranyl-aniline Openeye Name: N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]methyl]-3-chloro-aniline CAS Name: N-[[5-[(4-tert-butylphenyl)methylthio]-1,3,4-oxadiazol-2-yl]methyl]-3-chloroaniline IUPAC Name: N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]methyl]-3-chloroaniline Traditional Name: [5-[(4-tert-butylbenzyl)thio]-1,3,4-oxadiazol-2-yl]methyl-(3-chlorophenyl)amine Formula: C20H22ClN3OS MolecularWeight: 387.92618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(O2)CNC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(O2)CNC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3OS/c1-20(2,3)15-9-7-14(8-10-15)13-26-19-24-23-18(25-19)12-22-17-6-4-5-16(21)11-17/h4-11,22H,12-13H2,1-3H3