3-(1-adamantyl)-1-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-phenethyl-urea

Systemtic Name: 3-(1-adamantyl)-1-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-phenethyl-urea Openeye Name: 3-(1-adamantyl)-1-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-1-phenethyl-urea CAS Name: 3-(1-adamantyl)-1-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-1-phenethylurea IUPAC Name: 3-(1-adamantyl)-1-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-1-phenethylurea Traditional Name: 3-(1-adamantyl)-1-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]-1-phenethyl-urea Formula: C37H42N4O3 MolecularWeight: 590.75438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC4=CC=CC=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C37H42N4O3/c1-3-44-31-15-13-30(14-16-31)41-34(38-33-12-8-7-11-32(33)35(41)42)25(2)40(18-17-26-9-5-4-6-10-26)36(43)39-37-22-27-19-28(23-37)21-29(20-27)24-37/h4-16,25,27-29H,3,17-24H2,1-2H3,(H,39,43)