2-[4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide

Systemtic Name: 2-[4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide Openeye Name: 2-[4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide CAS Name: 2-[4-(5-tert-butyl-2-methylphenyl)sulfonyl-1-piperazinyl]-N-cyclopropylpropanamide IUPAC Name: 2-[4-(5-tert-butyl-2-methylphenyl)sulfonylpiperazin-1-yl]-N-cyclopropylpropanamide Traditional Name: 2-[4-(5-tert-butyl-2-methyl-phenyl)sulfonylpiperazino]-N-cyclopropyl-propionamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3CC3

InChI

InChI=1S/C21H33N3O3S/c1-15-6-7-17(21(3,4)5)14-19(15)28(26,27)24-12-10-23(11-13-24)16(2)20(25)22-18-8-9-18/h6-7,14,16,18H,8-13H2,1-5H3,(H,22,25)