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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NN2C(=O)C3=CC=CC=C3NC2=S)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N\N2C(=O)C3=CC=CC=C3NC2=S)OC

InChI

InChI=1S/C20H21N3O3S/c1-3-4-11-26-17-10-9-14(12-18(17)25-2)13-21-23-19(24)15-7-5-6-8-16(15)22-20(23)27/h5-10,12-13H,3-4,11H2,1-2H3,(H,22,27)/b21-13-