4-[1,2-bis(azanyl)-1-oxidanylidene-propan-2-yl]sulfonyl-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[1,2-bis(azanyl)-1-oxidanylidene-propan-2-yl]sulfonyl-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(1,2-diamino-1-methyl-2-oxo-ethyl)sulfonyl-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(1,2-diamino-1-oxopropan-2-yl)sulfonyl-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(1,2-diamino-1-oxopropan-2-yl)sulfonyl-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(1,2-diamino-2-keto-1-methyl-ethyl)sulfonyl-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C20H25N5O5S MolecularWeight: 447.508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)(N)S(=O)(=O)N1CCN(CC1)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N)(N)S(=O)(=O)N1CCN(CC1)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H25N5O5S/c1-20(22,18(21)26)31(28,29)25-13-11-24(12-14-25)19(27)23-15-7-9-17(10-8-15)30-16-5-3-2-4-6-16/h2-10H,11-14,22H2,1H3,(H2,21,26)(H,23,27)