N-[(E)-(2-heptoxyphenyl)methylideneamino]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide

Systemtic Name: N-[(E)-(2-heptoxyphenyl)methylideneamino]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]-N-[(E)-(2-heptoxyphenyl)methyleneamino]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[(E)-(2-heptoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[(E)-(2-heptoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(N-besyl-4-isopropyl-anilino)-N-[(E)-(2-heptoxybenzylidene)amino]acetamide Formula: C31H39N3O4S MolecularWeight: 549.72406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC=C1C=NNC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCOC1=CC=CC=C1/C=N/NC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H39N3O4S/c1-4-5-6-7-13-22-38-30-17-12-11-14-27(30)23-32-33-31(35)24-34(28-20-18-26(19-21-28)25(2)3)39(36,37)29-15-9-8-10-16-29/h8-12,14-21,23,25H,4-7,13,22,24H2,1-3H3,(H,33,35)/b32-23+