1-[2-(dibutylamino)propyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiourea

Systemtic Name: 1-[2-(dibutylamino)propyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiourea Openeye Name: 1-[2-(dibutylamino)propyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiourea CAS Name: 1-[2-(dibutylamino)propyl]-3-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]phenyl]thiourea IUPAC Name: 1-[2-(dibutylamino)propyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiourea Traditional Name: 1-[2-(dibutylamino)propyl]-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiourea Formula: C28H39N5O3S MolecularWeight: 525.70596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(C)CNC(=S)NC1=CC=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CCCCN(CCCC)C(C)CNC(=S)NC1=CC=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C28H39N5O3S/c1-6-8-14-33(15-9-7-2)20(3)18-29-28(37)32-21-10-12-22(13-11-21)36-27-23-16-25(34-4)26(35-5)17-24(23)30-19-31-27/h10-13,16-17,19-20H,6-9,14-15,18H2,1-5H3,(H2,29,32,37)