4-(4-tert-butylphenyl)sulfonyl-N-[(3-methylthiophen-2-yl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-tert-butylphenyl)sulfonyl-N-[(3-methylthiophen-2-yl)methyl]piperazine-1-carboxamide Openeye Name: 4-(4-tert-butylphenyl)sulfonyl-N-[(3-methyl-2-thienyl)methyl]piperazine-1-carboxamide CAS Name: 4-(4-tert-butylphenyl)sulfonyl-N-[(3-methyl-2-thiophenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-tert-butylphenyl)sulfonyl-N-[(3-methylthiophen-2-yl)methyl]piperazine-1-carboxamide Traditional Name: 4-(4-tert-butylphenyl)sulfonyl-N-[(3-methyl-2-thienyl)methyl]piperazine-1-carboxamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H29N3O3S2/c1-16-9-14-28-19(16)15-22-20(25)23-10-12-24(13-11-23)29(26,27)18-7-5-17(6-8-18)21(2,3)4/h5-9,14H,10-13,15H2,1-4H3,(H,22,25)