1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(3-pyrrolidin-1-ylpropyl)thiourea

Systemtic Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(3-pyrrolidin-1-ylpropyl)thiourea Openeye Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(3-pyrrolidin-1-ylpropyl)thiourea CAS Name: 1-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]phenyl]-3-[3-(1-pyrrolidinyl)propyl]thiourea IUPAC Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(3-pyrrolidin-1-ylpropyl)thiourea Traditional Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-(3-pyrrolidinopropyl)thiourea Formula: C24H29N5O3S MolecularWeight: 467.58376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)NC(=S)NCCCN4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)NC(=S)NCCCN4CCCC4)OC

InChI

InChI=1S/C24H29N5O3S/c1-30-21-14-19-20(15-22(21)31-2)26-16-27-23(19)32-18-8-6-17(7-9-18)28-24(33)25-10-5-13-29-11-3-4-12-29/h6-9,14-16H,3-5,10-13H2,1-2H3,(H2,25,28,33)