3-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(Z)-(4-isobutoxy-3-methoxy-phenyl)methyleneamino]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(Z)-[3-methoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(Z)-(4-isobutoxy-3-methoxy-benzylidene)amino]-2-thioxo-1H-quinazolin-4-one Formula: C20H21N3O3S MolecularWeight: 383.46404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=NN2C(=O)C3=CC=CC=C3NC2=S)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=N\N2C(=O)C3=CC=CC=C3NC2=S)OC

InChI

InChI=1S/C20H21N3O3S/c1-13(2)12-26-17-9-8-14(10-18(17)25-3)11-21-23-19(24)15-6-4-5-7-16(15)22-20(23)27/h4-11,13H,12H2,1-3H3,(H,22,27)/b21-11-