1-(1,2-benzoxazol-3-yl)-3-(2,6-diethylphenyl)thiourea

Systemtic Name: 1-(1,2-benzoxazol-3-yl)-3-(2,6-diethylphenyl)thiourea Openeye Name: 1-(1,2-benzoxazol-3-yl)-3-(2,6-diethylphenyl)thiourea CAS Name: 1-(1,2-benzoxazol-3-yl)-3-(2,6-diethylphenyl)thiourea IUPAC Name: 1-(1,2-benzoxazol-3-yl)-3-(2,6-diethylphenyl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-indoxazen-3-yl-thiourea Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=NOC3=CC=CC=C32

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=NOC3=CC=CC=C32

InChI

InChI=1S/C18H19N3OS/c1-3-12-8-7-9-13(4-2)16(12)19-18(23)20-17-14-10-5-6-11-15(14)22-21-17/h5-11H,3-4H2,1-2H3,(H2,19,20,21,23)