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

Systemtic Name: 4-(1-benzofuran-2-yl)-3-(hexan-2-ylideneamino)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-3-(1-methylpentylideneamino)-N-(2-nitrophenyl)thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-3-(hexan-2-ylideneamino)-N-(2-nitrophenyl)-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-3-(hexan-2-ylideneamino)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [4-(benzofuran-2-yl)-3-(1-methylpentylideneamino)-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NN1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC4=CC=CC=C4O3)C

Isomeric SMILES

CCCCC(=NN1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC4=CC=CC=C4O3)C

InChI

InChI=1S/C23H22N4O3S/c1-3-4-9-16(2)25-26-20(22-14-17-10-5-8-13-21(17)30-22)15-31-23(26)24-18-11-6-7-12-19(18)27(28)29/h5-8,10-15H,3-4,9H2,1-2H3