1-(4-nitrophenyl)-N-(2-propan-2-ylsulfanyl-1,3-benzothiazol-6-yl)methanimine

Systemtic Name: 1-(4-nitrophenyl)-N-(2-propan-2-ylsulfanyl-1,3-benzothiazol-6-yl)methanimine Openeye Name: N-(2-isopropylsulfanyl-1,3-benzothiazol-6-yl)-1-(4-nitrophenyl)methanimine CAS Name: 1-(4-nitrophenyl)-N-[2-(propan-2-ylthio)-1,3-benzothiazol-6-yl]methanimine IUPAC Name: 1-(4-nitrophenyl)-N-(2-propan-2-ylsulfanyl-1,3-benzothiazol-6-yl)methanimine Traditional Name: [2-(isopropylthio)-1,3-benzothiazol-6-yl]-(4-nitrobenzylidene)amine Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)SC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O2S2/c1-11(2)23-17-19-15-8-5-13(9-16(15)24-17)18-10-12-3-6-14(7-4-12)20(21)22/h3-11H,1-2H3