3-[(Z)-(3-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(Z)-(3-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(Z)-(3-ethoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(Z)-(3-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(Z)-(3-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(Z)-(3-ethoxy-4-propargyloxy-benzylidene)amino]-2-thioxo-1H-quinazolin-4-one Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2C(=O)C3=CC=CC=C3NC2=S)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N2C(=O)C3=CC=CC=C3NC2=S)OCC#C

InChI

InChI=1S/C20H17N3O3S/c1-3-11-26-17-10-9-14(12-18(17)25-4-2)13-21-23-19(24)15-7-5-6-8-16(15)22-20(23)27/h1,5-10,12-13H,4,11H2,2H3,(H,22,27)/b21-13-