1-[5-(4-nitrophenyl)furan-2-yl]-N-(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)methanimine

Systemtic Name: 1-[5-(4-nitrophenyl)furan-2-yl]-N-(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)methanimine Openeye Name: N-(2-allylsulfanyl-1,3-benzothiazol-6-yl)-1-[5-(4-nitrophenyl)-2-furyl]methanimine CAS Name: 1-[5-(4-nitrophenyl)-2-furanyl]-N-[2-(prop-2-enylthio)-1,3-benzothiazol-6-yl]methanimine IUPAC Name: 1-[5-(4-nitrophenyl)furan-2-yl]-N-(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)methanimine Traditional Name: [2-(allylthio)-1,3-benzothiazol-6-yl]-[[5-(4-nitrophenyl)-2-furyl]methylene]amine Formula: C21H15N3O3S2 MolecularWeight: 421.4921

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C=CCSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O3S2/c1-2-11-28-21-23-18-9-5-15(12-20(18)29-21)22-13-17-8-10-19(27-17)14-3-6-16(7-4-14)24(25)26/h2-10,12-13H,1,11H2