N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[methyl-[[4-(methylthio)phenyl]methyl]amino]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[methyl-[4-(methylthio)benzyl]amino]propionamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC2=C(C=C1)OCCO2)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC2=C(C=C1)OCCO2)N(C)CC3=CC=C(C=C3)SC

InChI

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