1-(2-methylphenyl)-3-[4-(5-phenyl-1,3-oxazol-2-yl)butanoylamino]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[4-(5-phenyl-1,3-oxazol-2-yl)butanoylamino]thiourea Openeye Name: 1-(o-tolyl)-3-[4-(5-phenyloxazol-2-yl)butanoylamino]thiourea CAS Name: 1-(2-methylphenyl)-3-[[1-oxo-4-(5-phenyl-2-oxazolyl)butyl]amino]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[4-(5-phenyl-1,3-oxazol-2-yl)butanoylamino]thiourea Traditional Name: 1-(o-tolyl)-3-[4-(5-phenyloxazol-2-yl)butanoylamino]thiourea Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)CCCC2=NC=C(O2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)CCCC2=NC=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-15-8-5-6-11-17(15)23-21(28)25-24-19(26)12-7-13-20-22-14-18(27-20)16-9-3-2-4-10-16/h2-6,8-11,14H,7,12-13H2,1H3,(H,24,26)(H2,23,25,28)