4-(1-benzofuran-2-yl)-3-(3-methylbutyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 4-(1-benzofuran-2-yl)-3-(3-methylbutyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-3-isopentyl-N-(2-nitrophenyl)thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-3-(3-methylbutyl)-N-(2-nitrophenyl)-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-3-(3-methylbutyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [4-(benzofuran-2-yl)-3-isoamyl-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(C)CCN1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H21N3O3S/c1-15(2)11-12-24-19(21-13-16-7-3-6-10-20(16)28-21)14-29-22(24)23-17-8-4-5-9-18(17)25(26)27/h3-10,13-15H,11-12H2,1-2H3