1-[(4-methylphenyl)methyl]-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea Openeye Name: 1-[4-(1-piperidylmethyl)phenyl]-3-(p-tolylmethyl)thiourea CAS Name: 1-[(4-methylphenyl)methyl]-3-[4-(1-piperidinylmethyl)phenyl]thiourea IUPAC Name: 1-[(4-methylphenyl)methyl]-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea Traditional Name: 1-(4-methylbenzyl)-3-[4-(piperidinomethyl)phenyl]thiourea Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)CN3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C21H27N3S/c1-17-5-7-18(8-6-17)15-22-21(25)23-20-11-9-19(10-12-20)16-24-13-3-2-4-14-24/h5-12H,2-4,13-16H2,1H3,(H2,22,23,25)