N-[[5-[4-(3-imidazol-1-ylpropylamino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-methoxy-benzamide

Systemtic Name: N-[[5-[4-(3-imidazol-1-ylpropylamino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-methoxy-benzamide Openeye Name: N-[[5-[[4-(3-imidazol-1-ylpropylamino)-1-piperidyl]sulfonyl]-2-thienyl]methyl]-3-methoxy-benzamide CAS Name: N-[[5-[[4-[3-(1-imidazolyl)propylamino]-1-piperidinyl]sulfonyl]-2-thiophenyl]methyl]-3-methoxybenzamide IUPAC Name: N-[[5-[4-(3-imidazol-1-ylpropylamino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-methoxybenzamide Traditional Name: N-[[5-[4-(3-imidazol-1-ylpropylamino)piperidino]sulfonyl-2-thienyl]methyl]-3-methoxy-benzamide Formula: C24H31N5O4S2 MolecularWeight: 517.66404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCC(CC3)NCCCN4C=CN=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCC(CC3)NCCCN4C=CN=C4

InChI

InChI=1S/C24H31N5O4S2/c1-33-21-5-2-4-19(16-21)24(30)27-17-22-6-7-23(34-22)35(31,32)29-13-8-20(9-14-29)26-10-3-12-28-15-11-25-18-28/h2,4-7,11,15-16,18,20,26H,3,8-10,12-14,17H2,1H3,(H,27,30)