(3R)-N-[(1R)-1-(furan-2-yl)-2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-N-(thiophen-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[(1R)-1-(furan-2-yl)-2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-N-(thiophen-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[(1R)-1-(2-furyl)-2-(isopentylamino)-2-oxo-ethyl]-N-(2-thienylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[(1R)-1-(2-furanyl)-2-(3-methylbutylamino)-2-oxoethyl]-N-(thiophen-2-ylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[(1R)-1-(furan-2-yl)-2-(3-methylbutylamino)-2-oxoethyl]-N-(thiophen-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[(1R)-1-(2-furyl)-2-(isoamylamino)-2-keto-ethyl]-N-(2-thenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C1=CC=CO1)N(CC2=CC=CS2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC(C)CCNC(=O)[C@@H](C1=CC=CO1)N(CC2=CC=CS2)C(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C25H28N2O5S/c1-17(2)11-12-26-24(28)23(21-10-5-13-30-21)27(15-18-7-6-14-33-18)25(29)22-16-31-19-8-3-4-9-20(19)32-22/h3-10,13-14,17,22-23H,11-12,15-16H2,1-2H3,(H,26,28)/t22-,23-/m1/s1