1-(3,5-dimethylphenyl)-3-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[[1-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]amino]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[[2-(3-keto-1,4-benzoxazin-4-yl)acetyl]amino]thiourea Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=O)CN2C(=O)COC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=O)CN2C(=O)COC3=CC=CC=C32)C

InChI

InChI=1S/C19H20N4O3S/c1-12-7-13(2)9-14(8-12)20-19(27)22-21-17(24)10-23-15-5-3-4-6-16(15)26-11-18(23)25/h3-9H,10-11H2,1-2H3,(H,21,24)(H2,20,22,27)