3-[(3,4-dimethoxyphenyl)methylamino]-2-thiophen-2-yl-quinazolin-4-one

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methylamino]-2-thiophen-2-yl-quinazolin-4-one Openeye Name: 3-[(3,4-dimethoxyphenyl)methylamino]-2-(2-thienyl)quinazolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)methylamino]-2-thiophen-2-yl-4-quinazolinone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methylamino]-2-thiophen-2-ylquinazolin-4-one Traditional Name: 2-(2-thienyl)-3-(veratrylamino)quinazolin-4-one Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNN2C(=NC3=CC=CC=C3C2=O)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNN2C(=NC3=CC=CC=C3C2=O)C4=CC=CS4)OC

InChI

InChI=1S/C21H19N3O3S/c1-26-17-10-9-14(12-18(17)27-2)13-22-24-20(19-8-5-11-28-19)23-16-7-4-3-6-15(16)21(24)25/h3-12,22H,13H2,1-2H3