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

Systemtic Name: 3-(4-butylphenyl)-1-ethyl-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 3-(4-butylphenyl)-1-ethyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(4-butylphenyl)-1-ethyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-(4-butylphenyl)-1-ethyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 3-(4-butylphenyl)-1-ethyl-1-[(4-keto-1H-quinazolin-2-yl)methyl]thiourea Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4OS/c1-3-5-8-16-11-13-17(14-12-16)23-22(28)26(4-2)15-20-24-19-10-7-6-9-18(19)21(27)25-20/h6-7,9-14H,3-5,8,15H2,1-2H3,(H,23,28)(H,24,25,27)