N-[2-[tert-butyl(furan-2-ylmethyl)amino]ethyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: N-[2-[tert-butyl(furan-2-ylmethyl)amino]ethyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: N-[2-[tert-butyl(2-furylmethyl)amino]ethyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: N-[2-[tert-butyl(2-furanylmethyl)amino]ethyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[2-[tert-butyl(furan-2-ylmethyl)amino]ethyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: N-[2-[tert-butyl(2-furfuryl)amino]ethyl]-2-keto-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CCNS(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2)CC3=CC=CO3

Isomeric SMILES

CC(C)(C)N(CCNS(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2)CC3=CC=CO3

InChI

InChI=1S/C21H29N3O4S/c1-21(2,3)24(15-17-7-5-13-28-17)12-11-22-29(26,27)18-9-10-19-16(14-18)6-4-8-20(25)23-19/h5,7,9-10,13-14,22H,4,6,8,11-12,15H2,1-3H3,(H,23,25)