1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=CC3=C(C=C2)OC(=N3)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=CC3=C(C=C2)OC(=N3)C

InChI

InChI=1S/C16H21N3OS/c1-10-5-3-4-6-13(10)19-16(21)18-12-7-8-15-14(9-12)17-11(2)20-15/h7-10,13H,3-6H2,1-2H3,(H2,18,19,21)/t10-,13-/m0/s1