1-[[7-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4H-quinolin-1-yl]amino]thiourea

Systemtic Name: 1-[[7-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4H-quinolin-1-yl]amino]thiourea Openeye Name: [[7-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]-4H-quinolin-1-yl]amino]thiourea CAS Name: [[7-chloro-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4H-quinolin-1-yl]amino]thiourea IUPAC Name: [[7-chloro-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-4H-quinolin-1-yl]amino]thiourea Traditional Name: [[7-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]-4H-quinolin-1-yl]amino]thiourea Formula: C16H14ClN5O3S MolecularWeight: 391.83206

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N(C2=C1C=CC(=C2)Cl)NNC(=S)N)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1C=C(N(C2=C1C=CC(=C2)Cl)NNC(=S)N)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN5O3S/c17-11-3-1-10-2-4-12(21(14(10)9-11)20-19-16(18)26)5-6-13-7-8-15(25-13)22(23)24/h1,3-9,20H,2H2,(H3,18,19,26)/b6-5+