N-aminocarbonyl-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-aminocarbonyl-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-N-carbamoyl-propanamide CAS Name: 2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-N-carbamoylpropanamide IUPAC Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-N-carbamoylpropanamide Traditional Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazino]-N-carbamoyl-propionamide Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC(=O)N)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H28N4O4S/c1-13(16(23)20-17(19)24)21-9-11-22(12-10-21)27(25,26)15-7-5-14(6-8-15)18(2,3)4/h5-8,13H,9-12H2,1-4H3,(H3,19,20,23,24)