3-[(Z)-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(Z)-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(Z)-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(Z)-[1-(4-ethoxyphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(Z)-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(Z)-(2,5-dimethyl-1-p-phenetyl-pyrrol-3-yl)methyleneamino]-2-thioxo-1H-quinazolin-4-one Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C=NN3C(=O)C4=CC=CC=C4NC3=S)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)/C=N\N3C(=O)C4=CC=CC=C4NC3=S)C

InChI

InChI=1S/C23H22N4O2S/c1-4-29-19-11-9-18(10-12-19)26-15(2)13-17(16(26)3)14-24-27-22(28)20-7-5-6-8-21(20)25-23(27)30/h5-14H,4H2,1-3H3,(H,25,30)/b24-14-