3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-cyclohexyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-cyclohexyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-N-cyclohexyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-N-cyclohexyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-N-cyclohexyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-N-cyclohexyl-2-keto-1,3-benzoxazole-6-sulfonamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)NC4CCCCC4)OC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)NC4CCCCC4)OC2=O

InChI

InChI=1S/C21H29N3O5S/c25-20(23-12-6-1-2-7-13-23)15-24-18-11-10-17(14-19(18)29-21(24)26)30(27,28)22-16-8-4-3-5-9-16/h10-11,14,16,22H,1-9,12-13,15H2