1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-(1,3-dioxoisoindolin-2-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-(1,3-dioxo-2-isoindolyl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-(1,3-dioxoisoindol-2-yl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-phthalimido-thiourea Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H19N3O2S/c1-10-6-2-5-9-13(10)17-16(22)18-19-14(20)11-7-3-4-8-12(11)15(19)21/h3-4,7-8,10,13H,2,5-6,9H2,1H3,(H2,17,18,22)/t10-,13-/m0/s1