2-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]propanoylamino]thiophene-3-carboxamide Formula: C20H26N4O4S2 MolecularWeight: 450.57484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=CS3)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=CS3)C(=O)N)C

InChI

InChI=1S/C20H26N4O4S2/c1-13-4-5-17(14(2)12-13)30(27,28)24-9-7-23(8-10-24)15(3)19(26)22-20-16(18(21)25)6-11-29-20/h4-6,11-12,15H,7-10H2,1-3H3,(H2,21,25)(H,22,26)