(2Z)-7-[[bis(2-methylpropyl)amino]methyl]-6-oxidanyl-2-(thiophen-2-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: (2Z)-7-[[bis(2-methylpropyl)amino]methyl]-6-oxidanyl-2-(thiophen-2-ylmethylidene)-1-benzofuran-3-one Openeye Name: (2Z)-7-[(diisobutylamino)methyl]-6-hydroxy-2-(2-thienylmethylene)benzofuran-3-one CAS Name: (2Z)-7-[[bis(2-methylpropyl)amino]methyl]-6-hydroxy-2-(thiophen-2-ylmethylidene)-3-benzofuranone IUPAC Name: (2Z)-7-[[bis(2-methylpropyl)amino]methyl]-6-hydroxy-2-(thiophen-2-ylmethylidene)-1-benzofuran-3-one Traditional Name: (2Z)-7-[(diisobutylamino)methyl]-6-hydroxy-2-(2-thenylidene)coumaran-3-one Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=C(C=CC2=C1OC(=CC3=CC=CS3)C2=O)O)CC(C)C

Isomeric SMILES

CC(C)CN(CC1=C(C=CC2=C1O/C(=C\C3=CC=CS3)/C2=O)O)CC(C)C

InChI

InChI=1S/C22H27NO3S/c1-14(2)11-23(12-15(3)4)13-18-19(24)8-7-17-21(25)20(26-22(17)18)10-16-6-5-9-27-16/h5-10,14-15,24H,11-13H2,1-4H3/b20-10-