N-[(2S)-3-[(3-aminophenyl)sulfonyl-(cyclopentylmethyl)amino]-2-oxidanyl-propyl]-N-phenethyl-pyridine-3-carboxamide

Systemtic Name: N-[(2S)-3-[(3-aminophenyl)sulfonyl-(cyclopentylmethyl)amino]-2-oxidanyl-propyl]-N-phenethyl-pyridine-3-carboxamide Openeye Name: N-[(2S)-3-[(3-aminophenyl)sulfonyl-(cyclopentylmethyl)amino]-2-hydroxy-propyl]-N-phenethyl-pyridine-3-carboxamide CAS Name: N-[(2S)-3-[(3-aminophenyl)sulfonyl-(cyclopentylmethyl)amino]-2-hydroxypropyl]-N-phenethyl-3-pyridinecarboxamide IUPAC Name: N-[(2S)-3-[(3-aminophenyl)sulfonyl-(cyclopentylmethyl)amino]-2-hydroxypropyl]-N-phenethylpyridine-3-carboxamide Traditional Name: N-[(2S)-3-[(3-aminophenyl)sulfonyl-(cyclopentylmethyl)amino]-2-hydroxy-propyl]-N-phenethyl-nicotinamide Formula: C29H36N4O4S MolecularWeight: 536.68554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN(CC(CN(CCC2=CC=CC=C2)C(=O)C3=CN=CC=C3)O)S(=O)(=O)C4=CC=CC(=C4)N

Isomeric SMILES

C1CCC(C1)CN(C[C@H](CN(CCC2=CC=CC=C2)C(=O)C3=CN=CC=C3)O)S(=O)(=O)C4=CC=CC(=C4)N

InChI

InChI=1S/C29H36N4O4S/c30-26-13-6-14-28(18-26)38(36,37)33(20-24-10-4-5-11-24)22-27(34)21-32(17-15-23-8-2-1-3-9-23)29(35)25-12-7-16-31-19-25/h1-3,6-9,12-14,16,18-19,24,27,34H,4-5,10-11,15,17,20-22,30H2/t27-/m0/s1