N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-butyl-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-butyl-2-thiophen-2-yl-ethanamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxo-chromen-3-yl)methyl]amino]-2-oxo-ethyl]-N-butyl-2-(2-thienyl)acetamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-N-butyl-2-thiophen-2-ylacetamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(6-chloro-4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-N-butyl-2-thiophen-2-ylacetamide Traditional Name: N-butyl-N-[2-[(6-chloro-4-keto-chromen-3-yl)methyl-piperonyl-amino]-2-keto-ethyl]-2-(2-thienyl)acetamide Formula: C30H29ClN2O6S MolecularWeight: 581.07906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)CC5=CC=CS5

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)CC5=CC=CS5

InChI

InChI=1S/C30H29ClN2O6S/c1-2-3-10-32(28(34)14-23-5-4-11-40-23)17-29(35)33(15-20-6-8-26-27(12-20)39-19-38-26)16-21-18-37-25-9-7-22(31)13-24(25)30(21)36/h4-9,11-13,18H,2-3,10,14-17,19H2,1H3