4-(4-cyanophenyl)sulfonyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]piperazine-1-carboxamide

Systemtic Name: 4-(4-cyanophenyl)sulfonyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]piperazine-1-carboxamide Openeye Name: 4-(4-cyanophenyl)sulfonyl-N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-cyanophenyl)sulfonyl-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1-piperazinecarboxamide IUPAC Name: 4-(4-cyanophenyl)sulfonyl-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]piperazine-1-carboxamide Traditional Name: 4-(4-cyanophenyl)sulfonyl-N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]piperazine-1-carboxamide Formula: C18H25N5O4S MolecularWeight: 407.4872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H25N5O4S/c1-3-8-20-17(24)14(2)21-18(25)22-9-11-23(12-10-22)28(26,27)16-6-4-15(13-19)5-7-16/h4-7,14H,3,8-12H2,1-2H3,(H,20,24)(H,21,25)/t14-/m0/s1