1-methyl-3-[(1S,2S)-2-methylcyclohexyl]-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea

Systemtic Name: 1-methyl-3-[(1S,2S)-2-methylcyclohexyl]-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea Openeye Name: 1-methyl-3-[(1S,2S)-2-methylcyclohexyl]-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea CAS Name: 1-methyl-3-[(1S,2S)-2-methylcyclohexyl]-1-[[2-(1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 1-methyl-3-[(1S,2S)-2-methylcyclohexyl]-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea Traditional Name: 1-methyl-3-[(1S,2S)-2-methylcyclohexyl]-1-(2-pyrrolidinobenzyl)thiourea Formula: C20H31N3S MolecularWeight: 345.54524

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)N(C)CC2=CC=CC=C2N3CCCC3

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)N(C)CC2=CC=CC=C2N3CCCC3

InChI

InChI=1S/C20H31N3S/c1-16-9-3-5-11-18(16)21-20(24)22(2)15-17-10-4-6-12-19(17)23-13-7-8-14-23/h4,6,10,12,16,18H,3,5,7-9,11,13-15H2,1-2H3,(H,21,24)/t16-,18-/m0/s1