2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoylamino]-4-methyl-thiophene-3-carboxamide

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoylamino]-4-methyl-thiophene-3-carboxamide Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoylamino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxobutyl]amino]-4-methyl-3-thiophenecarboxamide IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoylamino]-4-methylthiophene-3-carboxamide Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoylamino]-4-methyl-thiophene-3-carboxamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1C(=O)N)NC(=O)CCCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CSC(=C1C(=O)N)NC(=O)CCCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H20N2O4S/c1-11-10-25-18(16(11)17(19)22)20-15(21)4-2-3-12-5-6-13-14(9-12)24-8-7-23-13/h5-6,9-10H,2-4,7-8H2,1H3,(H2,19,22)(H,20,21)