N-[3-oxidanylidene-3-[4-(4-phenylmethoxyphenoxy)butylamino]propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[4-(4-phenylmethoxyphenoxy)butylamino]propyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-(4-benzyloxyphenoxy)butylamino]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-oxo-3-[4-(4-phenylmethoxyphenoxy)butylamino]propyl]-2-thiophenecarboxamide IUPAC Name: N-[3-oxo-3-[4-(4-phenylmethoxyphenoxy)butylamino]propyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-(4-benzoxyphenoxy)butylamino]-3-keto-propyl]thiophene-2-carboxamide Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCNC(=O)CCNC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCNC(=O)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C25H28N2O4S/c28-24(14-16-27-25(29)23-9-6-18-32-23)26-15-4-5-17-30-21-10-12-22(13-11-21)31-19-20-7-2-1-3-8-20/h1-3,6-13,18H,4-5,14-17,19H2,(H,26,28)(H,27,29)