1-(2,6-dimethylphenyl)-3-[6-methoxy-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-yl]thiourea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-yl]thiourea Openeye Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-yl]thiourea CAS Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[2-(1-pyrrolidinyl)ethoxy]-4-quinazolinyl]thiourea IUPAC Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-(2-pyrrolidin-1-ylethoxy)quinazolin-4-yl]thiourea Traditional Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-(2-pyrrolidinoethoxy)quinazolin-4-yl]thiourea Formula: C24H29N5O2S MolecularWeight: 451.58436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NC2=NC=NC3=CC(=C(C=C32)OC)OCCN4CCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NC2=NC=NC3=CC(=C(C=C32)OC)OCCN4CCCC4

InChI

InChI=1S/C24H29N5O2S/c1-16-7-6-8-17(2)22(16)27-24(32)28-23-18-13-20(30-3)21(14-19(18)25-15-26-23)31-12-11-29-9-4-5-10-29/h6-8,13-15H,4-5,9-12H2,1-3H3,(H2,25,26,27,28,32)