N-(3-imidazol-1-ylpropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carboxamide Formula: C21H31N5O3S MolecularWeight: 433.56754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)NCCCN3C=CN=C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)NCCCN3C=CN=C3)C)C

InChI

InChI=1S/C21H31N5O3S/c1-16-14-17(2)19(4)20(18(16)3)30(28,29)26-12-10-25(11-13-26)21(27)23-6-5-8-24-9-7-22-15-24/h7,9,14-15H,5-6,8,10-13H2,1-4H3,(H,23,27)