N-[3,5-bis(chloranyl)-4-methyl-phenyl]-3-(diisocyanomethylidene)-1-oxidanylidene-1-benzothiophen-2-imine

Systemtic Name: N-[3,5-bis(chloranyl)-4-methyl-phenyl]-3-(diisocyanomethylidene)-1-oxidanylidene-1-benzothiophen-2-imine Openeye Name: N-(3,5-dichloro-4-methyl-phenyl)-3-(diisocyanomethylene)-1-oxo-benzothiophen-2-imine CAS Name: N-(3,5-dichloro-4-methylphenyl)-3-(diisocyanomethylidene)-1-oxo-1-benzothiophen-2-imine IUPAC Name: N-(3,5-dichloro-4-methylphenyl)-3-(diisocyanomethylidene)-1-oxo-1-benzothiophen-2-imine Traditional Name: (3,5-dichloro-4-methyl-phenyl)-[3-(diisocyanomethylene)-1-keto-benzothiophen-2-ylidene]amine Formula: C18H9Cl2N3OS MolecularWeight: 386.25456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)N=C2C(=C([N+]#[C-])[N+]#[C-])C3=CC=CC=C3S2=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1Cl)N=C2C(=C([N+]#[C-])[N+]#[C-])C3=CC=CC=C3S2=O)Cl

InChI

InChI=1S/C18H9Cl2N3OS/c1-10-13(19)8-11(9-14(10)20)23-18-16(17(21-2)22-3)12-6-4-5-7-15(12)25(18)24/h4-9H,1H3