1-[(2S)-2-methylheptyl]-3-[[2-(phenylcarbonyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-[(2S)-2-methylheptyl]-3-[[2-(phenylcarbonyl)phenyl]carbonylamino]thiourea Openeye Name: 1-[(2-benzoylbenzoyl)amino]-3-[(2S)-2-methylheptyl]thiourea CAS Name: 1-[[(2-benzoylphenyl)-oxomethyl]amino]-3-[(2S)-2-methylheptyl]thiourea IUPAC Name: 1-[(2-benzoylbenzoyl)amino]-3-[(2S)-2-methylheptyl]thiourea Traditional Name: 1-[(2-benzoylbenzoyl)amino]-3-[(2S)-2-methylheptyl]thiourea Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H29N3O2S/c1-3-4-6-11-17(2)16-24-23(29)26-25-22(28)20-15-10-9-14-19(20)21(27)18-12-7-5-8-13-18/h5,7-10,12-15,17H,3-4,6,11,16H2,1-2H3,(H,25,28)(H2,24,26,29)/t17-/m0/s1