1-phenethyl-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-phenethyl-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-phenethyl-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea CAS Name: 1-phenethyl-3-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-phenethyl-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-phenethyl-3-[4-(pyrrolidinomethyl)benzyl]thiourea Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H27N3S/c25-21(22-13-12-18-6-2-1-3-7-18)23-16-19-8-10-20(11-9-19)17-24-14-4-5-15-24/h1-3,6-11H,4-5,12-17H2,(H2,22,23,25)