N-[1-oxidanylidene-3-phenyl-1-[[(E)-1-(phenylsulfonyl)hept-1-en-3-yl]amino]propan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[1-oxidanylidene-3-phenyl-1-[[(E)-1-(phenylsulfonyl)hept-1-en-3-yl]amino]propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[2-[1-[(E)-2-(benzenesulfonyl)vinyl]pentylamino]-1-benzyl-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[1-[[(E)-1-(benzenesulfonyl)hept-1-en-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[1-[[(E)-1-(benzenesulfonyl)hept-1-en-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[1-benzyl-2-[[(E)-3-besyl-1-butyl-allyl]amino]-2-keto-ethyl]morpholine-4-carboxamide Formula: C27H35N3O5S MolecularWeight: 513.6489

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=CS(=O)(=O)C1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N3CCOCC3

Isomeric SMILES

CCCCC(/C=C/S(=O)(=O)C1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N3CCOCC3

InChI

InChI=1S/C27H35N3O5S/c1-2-3-12-23(15-20-36(33,34)24-13-8-5-9-14-24)28-26(31)25(21-22-10-6-4-7-11-22)29-27(32)30-16-18-35-19-17-30/h4-11,13-15,20,23,25H,2-3,12,16-19,21H2,1H3,(H,28,31)(H,29,32)/b20-15+