1-butyl-3-(4-butylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea

Systemtic Name: 1-butyl-3-(4-butylphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 1-butyl-3-(4-butylphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 1-butyl-3-(4-butylphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 1-butyl-3-(4-butylphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-butyl-3-(4-butylphenyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]thiourea Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(CCCC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(CCCC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C24H30N4OS/c1-3-5-9-18-12-14-19(15-13-18)25-24(30)28(16-6-4-2)17-22-26-21-11-8-7-10-20(21)23(29)27-22/h7-8,10-15H,3-6,9,16-17H2,1-2H3,(H,25,30)(H,26,27,29)