1-[2-(1,2-benzoxazol-3-yl)ethanoylamino]-1-(4-methylphenyl)thiourea

Systemtic Name: 1-[2-(1,2-benzoxazol-3-yl)ethanoylamino]-1-(4-methylphenyl)thiourea Openeye Name: 1-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]-1-(p-tolyl)thiourea CAS Name: 1-[[2-(1,2-benzoxazol-3-yl)-1-oxoethyl]amino]-1-(4-methylphenyl)thiourea IUPAC Name: 1-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]-1-(4-methylphenyl)thiourea Traditional Name: 1-[(2-indoxazen-3-ylacetyl)amino]-1-(p-tolyl)thiourea Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(=S)N)NC(=O)CC2=NOC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)N(C(=S)N)NC(=O)CC2=NOC3=CC=CC=C32

InChI

InChI=1S/C17H16N4O2S/c1-11-6-8-12(9-7-11)21(17(18)24)19-16(22)10-14-13-4-2-3-5-15(13)23-20-14/h2-9H,10H2,1H3,(H2,18,24)(H,19,22)