N-(cycloheptylideneamino)-2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]ethanamide

Systemtic Name: N-(cycloheptylideneamino)-2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]ethanamide Openeye Name: N-(cycloheptylideneamino)-2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]acetamide CAS Name: N-(cycloheptylideneamino)-2-[(3,4-dimethoxyphenyl)sulfonyl-phenethylamino]acetamide IUPAC Name: N-(cycloheptylideneamino)-2-[(3,4-dimethoxyphenyl)sulfonyl-phenethylamino]acetamide Traditional Name: N-(cycloheptylideneamino)-2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]acetamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NN=C3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NN=C3CCCCCC3)OC

InChI

InChI=1S/C25H33N3O5S/c1-32-23-15-14-22(18-24(23)33-2)34(30,31)28(17-16-20-10-6-5-7-11-20)19-25(29)27-26-21-12-8-3-4-9-13-21/h5-7,10-11,14-15,18H,3-4,8-9,12-13,16-17,19H2,1-2H3,(H,27,29)