3,5-dimethyl-4-[(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-(2-thienylsulfonyl)-1,4-diazepan-1-yl]methyl]isoxazole CAS Name: 3,5-dimethyl-4-[(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[(4-thiophen-2-ylsulfonyl-1,4-diazepan-1-yl)methyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[4-(2-thienylsulfonyl)-1,4-diazepan-1-yl]methyl]isoxazole Formula: C15H21N3O3S2 MolecularWeight: 355.47554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C15H21N3O3S2/c1-12-14(13(2)21-16-12)11-17-6-4-7-18(9-8-17)23(19,20)15-5-3-10-22-15/h3,5,10H,4,6-9,11H2,1-2H3