N-[4-[[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]carbonylamino]carbamoyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]carbonylamino]carbamoyl]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[[[5-(azepan-1-ylsulfonyl)-2-methoxy-benzoyl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[[[[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-oxomethyl]hydrazo]-oxomethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[[[5-(azepan-1-ylsulfonyl)-2-methoxybenzoyl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[[[5-(azepan-1-ylsulfonyl)-2-methoxy-benzoyl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide Formula: C25H28N4O7S3 MolecularWeight: 592.70742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C25H28N4O7S3/c1-36-22-13-12-20(39(34,35)29-14-4-2-3-5-15-29)17-21(22)25(31)27-26-24(30)18-8-10-19(11-9-18)28-38(32,33)23-7-6-16-37-23/h6-13,16-17,28H,2-5,14-15H2,1H3,(H,26,30)(H,27,31)