N-[2-methyl-5-[(4-propyl-1,4-diazepan-1-yl)carbonyl]phenyl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[2-methyl-5-[(4-propyl-1,4-diazepan-1-yl)carbonyl]phenyl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[2-methyl-5-(4-propyl-1,4-diazepane-1-carbonyl)phenyl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[2-methyl-5-[oxo-(4-propyl-1,4-diazepan-1-yl)methyl]phenyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[2-methyl-5-(4-propyl-1,4-diazepane-1-carbonyl)phenyl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[2-methyl-5-(4-propyl-1,4-diazepane-1-carbonyl)phenyl]-1,3-benzodioxole-5-sulfonamide Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCN(CC1)C(=O)C2=CC(=C(C=C2)C)NS(=O)(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN1CCCN(CC1)C(=O)C2=CC(=C(C=C2)C)NS(=O)(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N3O5S/c1-3-9-25-10-4-11-26(13-12-25)23(27)18-6-5-17(2)20(14-18)24-32(28,29)19-7-8-21-22(15-19)31-16-30-21/h5-8,14-15,24H,3-4,9-13,16H2,1-2H3