N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-[(4-methoxyphenyl)sulfinylmethyl]furan-2-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-[(4-methoxyphenyl)sulfinylmethyl]furan-2-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-[(4-methoxyphenyl)sulfinylmethyl]furan-2-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-[(4-methoxyphenyl)sulfinylmethyl]-2-furancarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-[(4-methoxyphenyl)sulfinylmethyl]furan-2-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-[(4-methoxyphenyl)sulfinylmethyl]-2-furamide Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)CC2=CC=C(O2)C(=O)NCCCN3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)CC2=CC=C(O2)C(=O)NCCCN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H28N2O4S/c1-30-21-7-10-23(11-8-21)32(29)18-22-9-12-24(31-22)25(28)26-14-4-15-27-16-13-19-5-2-3-6-20(19)17-27/h2-3,5-12H,4,13-18H2,1H3,(H,26,28)