N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-butyl-N-[2-[(4-fluorobenzyl)-[(4-ketochromen-3-yl)methyl]amino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C28H27FN2O4S MolecularWeight: 506.588383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)C4=CC=CS4

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)C4=CC=CS4

InChI

InChI=1S/C28H27FN2O4S/c1-2-3-14-30(28(34)25-9-6-15-36-25)18-26(32)31(16-20-10-12-22(29)13-11-20)17-21-19-35-24-8-5-4-7-23(24)27(21)33/h4-13,15,19H,2-3,14,16-18H2,1H3