3,5-dimethyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]sulfonyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]sulfonyl]-1,2-oxazole Openeye Name: 4-[(4-benzyl-1,4-diazepan-1-yl)sulfonyl]-3,5-dimethyl-isoxazole CAS Name: 3,5-dimethyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]sulfonyl]isoxazole IUPAC Name: 4-[(4-benzyl-1,4-diazepan-1-yl)sulfonyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[(4-benzyl-1,4-diazepan-1-yl)sulfonyl]-3,5-dimethyl-isoxazole Formula: C17H23N3O3S MolecularWeight: 349.44782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N3O3S/c1-14-17(15(2)23-18-14)24(21,22)20-10-6-9-19(11-12-20)13-16-7-4-3-5-8-16/h3-5,7-8H,6,9-13H2,1-2H3