N-[3-(tert-butylamino)propyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-(tert-butylamino)propyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[3-(tert-butylamino)propyl]benzofuran-2-carboxamide CAS Name: N-[3-(tert-butylamino)propyl]-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-[3-(tert-butylamino)propyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-[3-(tert-butylamino)propyl]coumarilamide Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCCNC(=O)C1=C(C2=CC=CC=C2O1)CSCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NCCCNC(=O)C1=C(C2=CC=CC=C2O1)CSCC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O2S/c1-24(2,3)26-15-9-14-25-23(27)22-20(19-12-7-8-13-21(19)28-22)17-29-16-18-10-5-4-6-11-18/h4-8,10-13,26H,9,14-17H2,1-3H3,(H,25,27)