1-(1,2-benzoxazol-3-yl)-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-(1,2-benzoxazol-3-yl)-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-(1,2-benzoxazol-3-yl)thiourea CAS Name: 1-(4-acetylphenyl)-3-(1,2-benzoxazol-3-yl)thiourea IUPAC Name: 1-(4-acetylphenyl)-3-(1,2-benzoxazol-3-yl)thiourea Traditional Name: 1-(4-acetylphenyl)-3-indoxazen-3-yl-thiourea Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=NOC3=CC=CC=C32

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=NOC3=CC=CC=C32

InChI

InChI=1S/C16H13N3O2S/c1-10(20)11-6-8-12(9-7-11)17-16(22)18-15-13-4-2-3-5-14(13)21-19-15/h2-9H,1H3,(H2,17,18,19,22)