1-(6,7-dimethoxyquinazolin-4-yl)oxy-3-(2-dimethylaminoethyl)-1-phenyl-thiourea

Systemtic Name: 1-(6,7-dimethoxyquinazolin-4-yl)oxy-3-(2-dimethylaminoethyl)-1-phenyl-thiourea Openeye Name: 1-(6,7-dimethoxyquinazolin-4-yl)oxy-3-(2-dimethylaminoethyl)-1-phenyl-thiourea CAS Name: 1-[(6,7-dimethoxy-4-quinazolinyl)oxy]-3-(2-dimethylaminoethyl)-1-phenylthiourea IUPAC Name: 1-(6,7-dimethoxyquinazolin-4-yl)oxy-3-(2-dimethylaminoethyl)-1-phenylthiourea Traditional Name: 1-(6,7-dimethoxyquinazolin-4-yl)oxy-3-(2-dimethylaminoethyl)-1-phenyl-thiourea Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N(C1=CC=CC=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CN(C)CCNC(=S)N(C1=CC=CC=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C21H25N5O3S/c1-25(2)11-10-22-21(30)26(15-8-6-5-7-9-15)29-20-16-12-18(27-3)19(28-4)13-17(16)23-14-24-20/h5-9,12-14H,10-11H2,1-4H3,(H,22,30)