1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[3-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]sulfanylphenyl]urea

Systemtic Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[3-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]sulfanylphenyl]urea Openeye Name: 1-(5-tert-butylisoxazol-3-yl)-3-[3-[6-methoxy-7-[3-(1-piperidyl)propoxy]quinazolin-4-yl]sulfanylphenyl]urea CAS Name: 1-(5-tert-butyl-3-isoxazolyl)-3-[3-[[6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl]thio]phenyl]urea IUPAC Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[3-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]sulfanylphenyl]urea Traditional Name: 1-(5-tert-butylisoxazol-3-yl)-3-[3-[[6-methoxy-7-(3-piperidinopropoxy)quinazolin-4-yl]thio]phenyl]urea Formula: C31H38N6O4S MolecularWeight: 590.73622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=O)NC2=CC(=CC=C2)SC3=NC=NC4=CC(=C(C=C43)OC)OCCCN5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=O)NC2=CC(=CC=C2)SC3=NC=NC4=CC(=C(C=C43)OC)OCCCN5CCCCC5

InChI

InChI=1S/C31H38N6O4S/c1-31(2,3)27-19-28(36-41-27)35-30(38)34-21-10-8-11-22(16-21)42-29-23-17-25(39-4)26(18-24(23)32-20-33-29)40-15-9-14-37-12-6-5-7-13-37/h8,10-11,16-20H,5-7,9,12-15H2,1-4H3,(H2,34,35,36,38)