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

Systemtic Name: [6-cyano-4-(2-cyanoimino-1,3-thiazolidin-3-yl)-2,2-diethyl-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-4-(2-cyanoiminothiazolidin-3-yl)-2,2-diethyl-chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-4-(2-cyanoimino-3-thiazolidinyl)-2,2-diethyl-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-4-(2-cyanoimino-1,3-thiazolidin-3-yl)-2,2-diethyl-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-(2-cyanoiminothiazolidin-3-yl)-2,2-diethyl-chroman-3-yl] ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCSC3=NC#N)OC(=O)C)CC

Isomeric SMILES

CCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCSC3=NC#N)OC(=O)C)CC

InChI

InChI=1S/C20H22N4O3S/c1-4-20(5-2)18(26-13(3)25)17(24-8-9-28-19(24)23-12-22)15-10-14(11-21)6-7-16(15)27-20/h6-7,10,17-18H,4-5,8-9H2,1-3H3