2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazino]propanoylamino]thiophene-3-carboxamide Formula: C22H30N4O4S2 MolecularWeight: 478.628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H30N4O4S2/c1-15(20(28)24-21-18(19(23)27)9-14-31-21)25-10-12-26(13-11-25)32(29,30)17-7-5-16(6-8-17)22(2,3)4/h5-9,14-15H,10-13H2,1-4H3,(H2,23,27)(H,24,28)