1-[[(1S,2R)-2-(1,3-benzothiazol-2-yl)cyclohexyl]carbonylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[[(1S,2R)-2-(1,3-benzothiazol-2-yl)cyclohexyl]carbonylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[[(1S,2R)-2-(1,3-benzothiazol-2-yl)cyclohexanecarbonyl]amino]-3-isopropyl-thiourea CAS Name: 1-[[[(1S,2R)-2-(1,3-benzothiazol-2-yl)cyclohexyl]-oxomethyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[[(1S,2R)-2-(1,3-benzothiazol-2-yl)cyclohexanecarbonyl]amino]-3-propan-2-ylthiourea Traditional Name: 1-[[(1S,2R)-2-(1,3-benzothiazol-2-yl)cyclohexanecarbonyl]amino]-3-isopropyl-thiourea Formula: C18H24N4OS2 MolecularWeight: 376.53936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C1CCCCC1C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)NC(=S)NNC(=O)[C@H]1CCCC[C@H]1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H24N4OS2/c1-11(2)19-18(24)22-21-16(23)12-7-3-4-8-13(12)17-20-14-9-5-6-10-15(14)25-17/h5-6,9-13H,3-4,7-8H2,1-2H3,(H,21,23)(H2,19,22,24)/t12-,13+/m0/s1