1-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]thiourea CAS Name: 1-[[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[3-(2-keto-1,3-benzoxazol-3-yl)propanoylamino]-3-p-cumenyl-thiourea Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C20H22N4O3S/c1-13(2)14-7-9-15(10-8-14)21-19(28)23-22-18(25)11-12-24-16-5-3-4-6-17(16)27-20(24)26/h3-10,13H,11-12H2,1-2H3,(H,22,25)(H2,21,23,28)