N-[2-[[2-methoxy-5-(2-pyrrolidin-1-ylethylsulfonyl)phenyl]sulfonylamino]phenyl]-1-benzothiophene-2-sulfonamide

Systemtic Name: N-[2-[[2-methoxy-5-(2-pyrrolidin-1-ylethylsulfonyl)phenyl]sulfonylamino]phenyl]-1-benzothiophene-2-sulfonamide Openeye Name: N-[2-[[2-methoxy-5-(2-pyrrolidin-1-ylethylsulfonyl)phenyl]sulfonylamino]phenyl]benzothiophene-2-sulfonamide CAS Name: N-[2-[[2-methoxy-5-[2-(1-pyrrolidinyl)ethylsulfonyl]phenyl]sulfonylamino]phenyl]-1-benzothiophene-2-sulfonamide IUPAC Name: N-[2-[[2-methoxy-5-(2-pyrrolidin-1-ylethylsulfonyl)phenyl]sulfonylamino]phenyl]-1-benzothiophene-2-sulfonamide Traditional Name: N-[2-[[2-methoxy-5-(2-pyrrolidinoethylsulfonyl)phenyl]sulfonylamino]phenyl]benzothiophene-2-sulfonamide Formula: C27H29N3O7S4 MolecularWeight: 635.79506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)CCN2CCCC2)S(=O)(=O)NC3=CC=CC=C3NS(=O)(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)CCN2CCCC2)S(=O)(=O)NC3=CC=CC=C3NS(=O)(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C27H29N3O7S4/c1-37-24-13-12-21(39(31,32)17-16-30-14-6-7-15-30)19-26(24)40(33,34)28-22-9-3-4-10-23(22)29-41(35,36)27-18-20-8-2-5-11-25(20)38-27/h2-5,8-13,18-19,28-29H,6-7,14-17H2,1H3