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

Systemtic Name: 1-butyl-3-[(4-oxidanylidene-1H-quinazolin-2-yl)carbonylamino]thiourea Openeye Name: 1-butyl-3-[(4-oxo-1H-quinazoline-2-carbonyl)amino]thiourea CAS Name: 1-butyl-3-[[oxo-(4-oxo-1H-quinazolin-2-yl)methyl]amino]thiourea IUPAC Name: 1-butyl-3-[(4-oxo-1H-quinazoline-2-carbonyl)amino]thiourea Traditional Name: 1-butyl-3-[(4-keto-1H-quinazoline-2-carbonyl)amino]thiourea Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CCCCNC(=S)NNC(=O)C1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C14H17N5O2S/c1-2-3-8-15-14(22)19-18-13(21)11-16-10-7-5-4-6-9(10)12(20)17-11/h4-7H,2-3,8H2,1H3,(H,18,21)(H2,15,19,22)(H,16,17,20)