N-[[5-[3-(butylamino)pyrrolidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-methoxy-benzamide

Systemtic Name: N-[[5-[3-(butylamino)pyrrolidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-methoxy-benzamide Openeye Name: N-[[5-[3-(butylamino)pyrrolidin-1-yl]sulfonyl-2-thienyl]methyl]-3-methoxy-benzamide CAS Name: N-[[5-[[3-(butylamino)-1-pyrrolidinyl]sulfonyl]-2-thiophenyl]methyl]-3-methoxybenzamide IUPAC Name: N-[[5-[3-(butylamino)pyrrolidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-methoxybenzamide Traditional Name: N-[[5-[3-(butylamino)pyrrolidino]sulfonyl-2-thienyl]methyl]-3-methoxy-benzamide Formula: C21H29N3O4S2 MolecularWeight: 451.60266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCNC1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H29N3O4S2/c1-3-4-11-22-17-10-12-24(15-17)30(26,27)20-9-8-19(29-20)14-23-21(25)16-6-5-7-18(13-16)28-2/h5-9,13,17,22H,3-4,10-12,14-15H2,1-2H3,(H,23,25)