N'-[(E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]-5-ethyl-4-methyl-thiophene-2-carbohydrazide

Systemtic Name: N'-[(E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]-5-ethyl-4-methyl-thiophene-2-carbohydrazide Openeye Name: N'-[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]-5-ethyl-4-methyl-thiophene-2-carbohydrazide CAS Name: N'-[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-oxoprop-2-enyl]-5-ethyl-4-methyl-2-thiophenecarbohydrazide IUPAC Name: N'-[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]-5-ethyl-4-methylthiophene-2-carbohydrazide Traditional Name: N'-[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acryloyl]-5-ethyl-4-methyl-thiophene-2-carbohydrazide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NNC(=O)C=CC2=CC3=C(C(=C2)Cl)OCCCO3)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NNC(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCCCO3)C

InChI

InChI=1S/C20H21ClN2O4S/c1-3-16-12(2)9-17(28-16)20(25)23-22-18(24)6-5-13-10-14(21)19-15(11-13)26-7-4-8-27-19/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,22,24)(H,23,25)/b6-5+