N-[(E)-[5-(1,3-benzothiazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-4-nitro-aniline

Systemtic Name: N-[(E)-[5-(1,3-benzothiazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-4-nitro-aniline Openeye Name: N-[(E)-[5-(1,3-benzothiazol-2-ylsulfanyl)-2-furyl]methyleneamino]-4-nitro-aniline CAS Name: N-[(E)-[5-(1,3-benzothiazol-2-ylthio)-2-furanyl]methylideneamino]-4-nitroaniline IUPAC Name: N-[(E)-[5-(1,3-benzothiazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-4-nitroaniline Traditional Name: [(E)-[5-(1,3-benzothiazol-2-ylthio)-2-furyl]methyleneamino]-(4-nitrophenyl)amine Formula: C18H12N4O3S2 MolecularWeight: 396.44288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=CC=C(O3)C=NNC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=CC=C(O3)/C=N/NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O3S2/c23-22(24)13-7-5-12(6-8-13)21-19-11-14-9-10-17(25-14)27-18-20-15-3-1-2-4-16(15)26-18/h1-11,21H/b19-11+