2-[[4-[(4-cyano-3-methyl-1,2-thiazol-5-yl)diazenyl]-3-methyl-phenyl]-ethyl-amino]ethyl ethanoate

Systemtic Name: 2-[[4-[(4-cyano-3-methyl-1,2-thiazol-5-yl)diazenyl]-3-methyl-phenyl]-ethyl-amino]ethyl ethanoate Openeye Name: 2-[4-(4-cyano-3-methyl-isothiazol-5-yl)azo-N-ethyl-3-methyl-anilino]ethyl acetate CAS Name: acetic acid 2-[4-[(4-cyano-3-methyl-5-isothiazolyl)azo]-N-ethyl-3-methylanilino]ethyl ester IUPAC Name: 2-[4-[(4-cyano-3-methyl-1,2-thiazol-5-yl)diazenyl]-N-ethyl-3-methylanilino]ethyl acetate Traditional Name: acetic acid 2-[4-(4-cyano-3-methyl-isothiazol-5-yl)azo-N-ethyl-3-methyl-anilino]ethyl ester Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C(=NS2)C)C#N)C

Isomeric SMILES

CCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C(=NS2)C)C#N)C

InChI

InChI=1S/C18H21N5O2S/c1-5-23(8-9-25-14(4)24)15-6-7-17(12(2)10-15)20-21-18-16(11-19)13(3)22-26-18/h6-7,10H,5,8-9H2,1-4H3