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

Systemtic Name: 3-(4-butylphenyl)-1-(2-methoxyethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 3-(4-butylphenyl)-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(4-butylphenyl)-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-(4-butylphenyl)-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 3-(4-butylphenyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-methoxyethyl)thiourea Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2S/c1-3-4-7-17-10-12-18(13-11-17)24-23(30)27(14-15-29-2)16-21-25-20-9-6-5-8-19(20)22(28)26-21/h5-6,8-13H,3-4,7,14-16H2,1-2H3,(H,24,30)(H,25,26,28)