1-cyclohexyl-3-[3-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]urea

Systemtic Name: 1-cyclohexyl-3-[3-[4-[(3-methyl-4-pyridin-3-yloxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]urea Openeye Name: 1-cyclohexyl-3-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]urea CAS Name: 1-cyclohexyl-3-[3-[4-[3-methyl-4-(3-pyridinyloxy)anilino]-6-quinazolinyl]prop-2-ynyl]urea IUPAC Name: 1-cyclohexyl-3-[3-[4-(3-methyl-4-pyridin-3-yloxyanilino)quinazolin-6-yl]prop-2-ynyl]urea Traditional Name: 1-cyclohexyl-3-[3-[4-[3-methyl-4-(3-pyridyloxy)anilino]quinazolin-6-yl]prop-2-ynyl]urea Formula: C30H30N6O2 MolecularWeight: 506.5982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCNC(=O)NC4CCCCC4)OC5=CN=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCNC(=O)NC4CCCCC4)OC5=CN=CC=C5

InChI

InChI=1S/C30H30N6O2/c1-21-17-24(12-14-28(21)38-25-10-6-15-31-19-25)35-29-26-18-22(11-13-27(26)33-20-34-29)7-5-16-32-30(37)36-23-8-3-2-4-9-23/h6,10-15,17-20,23H,2-4,8-9,16H2,1H3,(H2,32,36,37)(H,33,34,35)