N-(2-methoxyphenyl)-4-(4-nitrophenyl)-3-(oxolan-2-ylmethyl)-1,3-thiazol-2-imine

Systemtic Name: N-(2-methoxyphenyl)-4-(4-nitrophenyl)-3-(oxolan-2-ylmethyl)-1,3-thiazol-2-imine Openeye Name: N-(2-methoxyphenyl)-4-(4-nitrophenyl)-3-(tetrahydrofuran-2-ylmethyl)thiazol-2-imine CAS Name: N-(2-methoxyphenyl)-4-(4-nitrophenyl)-3-(2-oxolanylmethyl)-2-thiazolimine IUPAC Name: N-(2-methoxyphenyl)-4-(4-nitrophenyl)-3-(oxolan-2-ylmethyl)-1,3-thiazol-2-imine Traditional Name: (2-methoxyphenyl)-[4-(4-nitrophenyl)-3-(tetrahydrofurfuryl)-4-thiazolin-2-ylidene]amine Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])CC4CCCO4

Isomeric SMILES

COC1=CC=CC=C1N=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])CC4CCCO4

InChI

InChI=1S/C21H21N3O4S/c1-27-20-7-3-2-6-18(20)22-21-23(13-17-5-4-12-28-17)19(14-29-21)15-8-10-16(11-9-15)24(25)26/h2-3,6-11,14,17H,4-5,12-13H2,1H3