N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[ethyl(p-anisylthiocarbamoyl)amino]acetamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=S)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=S)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O4S/c1-3-24(21(29)22-13-15-4-7-17(26-2)8-5-15)14-20(25)23-16-6-9-18-19(12-16)28-11-10-27-18/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,22,29)(H,23,25)