3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(4-nitrophenyl)-N-propan-2-yl-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(4-nitrophenyl)-N-propan-2-yl-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-N-isopropyl-4-(4-nitrophenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(4-nitrophenyl)-N-propan-2-yl-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(4-nitrophenyl)-N-propan-2-yl-1,3-thiazol-2-imine Traditional Name: isopropyl-[4-(4-nitrophenyl)-3-(piperonylideneamino)-4-thiazolin-2-ylidene]amine Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])N=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N4O4S/c1-13(2)22-20-23(21-10-14-3-8-18-19(9-14)28-12-27-18)17(11-29-20)15-4-6-16(7-5-15)24(25)26/h3-11,13H,12H2,1-2H3