(2S)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2S)-N-(isopropylcarbamoyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: (2S)-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2S)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2S)-N-(isopropylcarbamoyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazino]propionamide Formula: C18H28N4O5S MolecularWeight: 412.50372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H28N4O5S/c1-13(2)19-18(24)20-17(23)14(3)21-9-11-22(12-10-21)28(25,26)16-7-5-15(27-4)6-8-16/h5-8,13-14H,9-12H2,1-4H3,(H2,19,20,23,24)/t14-/m0/s1