2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide

Systemtic Name: 2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide Openeye Name: 2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide CAS Name: 2-[[2-(cyclopropylamino)-2-oxoethyl]thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide IUPAC Name: 2-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide Traditional Name: 2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSC2=CC=CC=C2C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CC1NC(=O)CSC2=CC=CC=C2C(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N2O4S/c24-20(23-14-9-10-14)13-28-19-8-4-1-5-16(19)21(25)22-11-15-12-26-17-6-2-3-7-18(17)27-15/h1-8,14-15H,9-13H2,(H,22,25)(H,23,24)