N-(2,2-diphenylethyl)-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide

Systemtic Name: N-(2,2-diphenylethyl)-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide Openeye Name: N-(2,2-diphenylethyl)-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide CAS Name: N-(2,2-diphenylethyl)-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide IUPAC Name: N-(2,2-diphenylethyl)-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide Traditional Name: N-(2,2-diphenylethyl)-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepane-1-carbothioamide Formula: C29H31N5OS MolecularWeight: 497.65434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=S)NCC(C2=CC=CC=C2)C3=CC=CC=C3)CC4=NOC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN(C1)C(=S)NCC(C2=CC=CC=C2)C3=CC=CC=C3)CC4=NOC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5OS/c36-29(30-21-26(23-11-4-1-5-12-23)24-13-6-2-7-14-24)34-18-10-17-33(19-20-34)22-27-31-28(35-32-27)25-15-8-3-9-16-25/h1-9,11-16,26H,10,17-22H2,(H,30,36)