3-(2,3-dimethylphenyl)-7-(3-propan-2-yloxypropylcarbamoyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(2,3-dimethylphenyl)-7-(3-propan-2-yloxypropylcarbamoyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(2,3-dimethylphenyl)-7-(3-isopropoxypropylcarbamoyl)-2-thioxo-quinazolin-4-olate CAS Name: 3-(2,3-dimethylphenyl)-7-[oxo-(3-propan-2-yloxypropylamino)methyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(2,3-dimethylphenyl)-7-(3-propan-2-yloxypropylcarbamoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(2,3-dimethylphenyl)-7-(3-isopropoxypropylcarbamoyl)-2-thioxo-quinazolin-4-olate Formula: C23H26N3O3S- MolecularWeight: 424.53584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=C3C=CC(=CC3=NC2=S)C(=O)NCCCOC(C)C)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=C3C=CC(=CC3=NC2=S)C(=O)NCCCOC(C)C)[O-])C

InChI

InChI=1S/C23H27N3O3S/c1-14(2)29-12-6-11-24-21(27)17-9-10-18-19(13-17)25-23(30)26(22(18)28)20-8-5-7-15(3)16(20)4/h5,7-10,13-14,28H,6,11-12H2,1-4H3,(H,24,27)/p-1