N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide

Systemtic Name: N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide Openeye Name: N-[(E)-(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-3-phenyl-3-(p-tolylsulfonylamino)propanamide CAS Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide IUPAC Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide Traditional Name: N-[(E)-(5-bromo-2-propargyloxy-benzylidene)amino]-3-phenyl-3-(tosylamino)propionamide Formula: C26H24BrN3O4S MolecularWeight: 554.45546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NN=CC2=C(C=CC(=C2)Br)OCC#C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)N/N=C/C2=C(C=CC(=C2)Br)OCC#C)C3=CC=CC=C3

InChI

InChI=1S/C26H24BrN3O4S/c1-3-15-34-25-14-11-22(27)16-21(25)18-28-29-26(31)17-24(20-7-5-4-6-8-20)30-35(32,33)23-12-9-19(2)10-13-23/h1,4-14,16,18,24,30H,15,17H2,2H3,(H,29,31)/b28-18+