N-[4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-sulfonamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N4O3S2/c26-21(25-13-11-24(12-14-25)16-17-7-9-22-10-8-17)18-3-5-19(6-4-18)23-30(27,28)20-2-1-15-29-20/h1-10,15,23H,11-14,16H2