3-[4-[(5-cyano-3-isocyano-4-methyl-thiophen-2-yl)diazenyl]-3-methyl-phenyl]propyl N-methylcarbamate

Systemtic Name: 3-[4-[(5-cyano-3-isocyano-4-methyl-thiophen-2-yl)diazenyl]-3-methyl-phenyl]propyl N-methylcarbamate Openeye Name: 3-[4-[(5-cyano-3-isocyano-4-methyl-2-thienyl)azo]-3-methyl-phenyl]propyl N-methylcarbamate CAS Name: N-methylcarbamic acid 3-[4-[(5-cyano-3-isocyano-4-methyl-2-thiophenyl)azo]-3-methylphenyl]propyl ester IUPAC Name: 3-[4-[(5-cyano-3-isocyano-4-methylthiophen-2-yl)diazenyl]-3-methylphenyl]propyl N-methylcarbamate Traditional Name: N-methylcarbamic acid 3-[4-[(5-cyano-3-isocyano-4-methyl-2-thienyl)azo]-3-methyl-phenyl]propyl ester Formula: C19H19N5O2S MolecularWeight: 381.45146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCCOC(=O)NC)N=NC2=C(C(=C(S2)C#N)C)[N+]#[C-]

Isomeric SMILES

CC1=C(C=CC(=C1)CCCOC(=O)NC)N=NC2=C(C(=C(S2)C#N)C)[N+]#[C-]

InChI

InChI=1S/C19H19N5O2S/c1-12-10-14(6-5-9-26-19(25)22-4)7-8-15(12)23-24-18-17(21-3)13(2)16(11-20)27-18/h7-8,10H,5-6,9H2,1-2,4H3,(H,22,25)