N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC2=C(S1)CCCC2)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C/C(=N\NC(=O)C1=CC2=C(S1)CCCC2)/CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O3S/c1-13(6-7-14-8-9-16-17(10-14)25-12-24-16)21-22-20(23)19-11-15-4-2-3-5-18(15)26-19/h8-11H,2-7,12H2,1H3,(H,22,23)/b21-13+