N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-[4-(3-thienylmethyl)piperazin-1-yl]acetamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-[4-(3-thiophenylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-[4-(3-thenyl)piperazino]acetamide Formula: C23H32N4O4S2 MolecularWeight: 492.65458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CSC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CSC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H32N4O4S2/c1-2-31-21-6-5-20(15-22(21)33(29,30)27-8-3-4-9-27)24-23(28)17-26-12-10-25(11-13-26)16-19-7-14-32-18-19/h5-7,14-15,18H,2-4,8-13,16-17H2,1H3,(H,24,28)