3-(3-azanylpropyl)-2-[5-(2,4-dimethoxyphenyl)thiophen-2-yl]quinazolin-4-one

Systemtic Name: 3-(3-azanylpropyl)-2-[5-(2,4-dimethoxyphenyl)thiophen-2-yl]quinazolin-4-one Openeye Name: 3-(3-aminopropyl)-2-[5-(2,4-dimethoxyphenyl)-2-thienyl]quinazolin-4-one CAS Name: 3-(3-aminopropyl)-2-[5-(2,4-dimethoxyphenyl)-2-thiophenyl]-4-quinazolinone IUPAC Name: 3-(3-aminopropyl)-2-[5-(2,4-dimethoxyphenyl)thiophen-2-yl]quinazolin-4-one Traditional Name: 3-(3-aminopropyl)-2-[5-(2,4-dimethoxyphenyl)-2-thienyl]quinazolin-4-one Formula: C23H23N3O3S MolecularWeight: 421.51202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(S2)C3=NC4=CC=CC=C4C(=O)N3CCCN)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(S2)C3=NC4=CC=CC=C4C(=O)N3CCCN)OC

InChI

InChI=1S/C23H23N3O3S/c1-28-15-8-9-17(19(14-15)29-2)20-10-11-21(30-20)22-25-18-7-4-3-6-16(18)23(27)26(22)13-5-12-24/h3-4,6-11,14H,5,12-13,24H2,1-2H3