1-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonyl-3-methyl-thieno[2,3-b]pyridin-5-yl]ethanone

Systemtic Name: 1-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonyl-3-methyl-thieno[2,3-b]pyridin-5-yl]ethanone Openeye Name: 1-[3-methyl-2-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]thieno[2,3-b]pyridin-5-yl]ethanone CAS Name: 1-[2-[[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-3-methyl-5-thieno[2,3-b]pyridinyl]ethanone IUPAC Name: 1-[2-[4-(4-butan-2-ylphenyl)sulfonylpiperazine-1-carbonyl]-3-methylthieno[2,3-b]pyridin-5-yl]ethanone Traditional Name: 1-[3-methyl-2-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]thieno[2,3-b]pyridin-5-yl]ethanone Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C4=CC(=CN=C4S3)C(=O)C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C4=CC(=CN=C4S3)C(=O)C)C

InChI

InChI=1S/C25H29N3O4S2/c1-5-16(2)19-6-8-21(9-7-19)34(31,32)28-12-10-27(11-13-28)25(30)23-17(3)22-14-20(18(4)29)15-26-24(22)33-23/h6-9,14-16H,5,10-13H2,1-4H3