1-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-(4-nitrophenyl)-1-pentyl-urea

Systemtic Name: 1-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-(4-nitrophenyl)-1-pentyl-urea Openeye Name: 1-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-3-(4-nitrophenyl)-1-pentyl-urea CAS Name: 1-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-(4-nitrophenyl)-1-pentylurea IUPAC Name: 1-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-(4-nitrophenyl)-1-pentylurea Traditional Name: 1-amyl-1-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]ethyl]-3-(4-nitrophenyl)urea Formula: C30H33N5O4 MolecularWeight: 527.61412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)CC)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)CC)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C30H33N5O4/c1-4-6-9-20-33(30(37)31-23-14-18-25(19-15-23)35(38)39)21(3)28-32-27-11-8-7-10-26(27)29(36)34(28)24-16-12-22(5-2)13-17-24/h7-8,10-19,21H,4-6,9,20H2,1-3H3,(H,31,37)