5-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-(o-tolylmethyl)-1,4-diazepan-1-yl]methyl]-3-(3-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-3-(3-thiophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Traditional Name: 5-[[4-(2-methylbenzyl)-1,4-diazepan-1-yl]methyl]-3-(3-thienyl)-1,2,4-oxadiazole Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)CC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)CC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C20H24N4OS/c1-16-5-2-3-6-17(16)13-23-8-4-9-24(11-10-23)14-19-21-20(22-25-19)18-7-12-26-15-18/h2-3,5-7,12,15H,4,8-11,13-14H2,1H3