[6-cyano-4-(2-cyanoimino-1,3-thiazolidin-3-yl)-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate

Systemtic Name: [6-cyano-4-(2-cyanoimino-1,3-thiazolidin-3-yl)-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-4-(2-cyanoiminothiazolidin-3-yl)-2,2-dimethyl-chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-4-(2-cyanoimino-3-thiazolidinyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-4-(2-cyanoimino-1,3-thiazolidin-3-yl)-2,2-dimethyl-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-(2-cyanoiminothiazolidin-3-yl)-2,2-dimethyl-chroman-3-yl] ester Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CCSC3=NC#N

Isomeric SMILES

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CCSC3=NC#N

InChI

InChI=1S/C18H18N4O3S/c1-11(23)24-16-15(22-6-7-26-17(22)21-10-20)13-8-12(9-19)4-5-14(13)25-18(16,2)3/h4-5,8,15-16H,6-7H2,1-3H3