N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-4-morpholin-4-ylsulfonyl-N-phenethyl-benzamide

Systemtic Name: N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-4-morpholin-4-ylsulfonyl-N-phenethyl-benzamide Openeye Name: N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxo-ethyl]-4-morpholinosulfonyl-N-phenethyl-benzamide CAS Name: N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-4-(4-morpholinylsulfonyl)-N-phenethylbenzamide IUPAC Name: N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-4-morpholin-4-ylsulfonyl-N-phenethylbenzamide Traditional Name: N-[2-(cyclopentylamino)-2-keto-1-(4-methoxyphenyl)ethyl]-4-morpholinosulfonyl-N-phenethyl-benzamide Formula: C33H39N3O6S MolecularWeight: 605.74426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=O)NC2CCCC2)N(CCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(C(=O)NC2CCCC2)N(CCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C33H39N3O6S/c1-41-29-15-11-26(12-16-29)31(32(37)34-28-9-5-6-10-28)36(20-19-25-7-3-2-4-8-25)33(38)27-13-17-30(18-14-27)43(39,40)35-21-23-42-24-22-35/h2-4,7-8,11-18,28,31H,5-6,9-10,19-24H2,1H3,(H,34,37)