(2S)-2-(4-cyclopropylcarbonylpiperazin-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: (2S)-2-(4-cyclopropylcarbonylpiperazin-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: (2S)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazino]-N-(4-morpholinosulfonylphenyl)propionamide Formula: C21H30N4O5S MolecularWeight: 450.5517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C21H30N4O5S/c1-16(23-8-10-24(11-9-23)21(27)17-2-3-17)20(26)22-18-4-6-19(7-5-18)31(28,29)25-12-14-30-15-13-25/h4-7,16-17H,2-3,8-15H2,1H3,(H,22,26)/t16-/m0/s1