N-[4-oxidanylidene-4-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methylamino]butyl]benzamide

Systemtic Name: N-[4-oxidanylidene-4-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methylamino]butyl]benzamide Openeye Name: N-[4-oxo-4-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methylamino]butyl]benzamide CAS Name: N-[4-oxo-4-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methylamino]butyl]benzamide IUPAC Name: N-[4-oxo-4-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methylamino]butyl]benzamide Traditional Name: N-[4-keto-4-[(5-pyrrolidinosulfonyl-2-thienyl)methylamino]butyl]benzamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)CCCNC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)CCCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O4S2/c24-18(9-6-12-21-20(25)16-7-2-1-3-8-16)22-15-17-10-11-19(28-17)29(26,27)23-13-4-5-14-23/h1-3,7-8,10-11H,4-6,9,12-15H2,(H,21,25)(H,22,24)