1-[(1S,2S)-2-methylcyclohexyl]-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea Traditional Name: 1-[4-(2-ketopyrrolidino)benzyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C19H27N3OS MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NCC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NCC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C19H27N3OS/c1-14-5-2-3-6-17(14)21-19(24)20-13-15-8-10-16(11-9-15)22-12-4-7-18(22)23/h8-11,14,17H,2-7,12-13H2,1H3,(H2,20,21,24)/t14-,17-/m0/s1