1-(2-ethylphenyl)-3-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(2-ethylphenyl)-3-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(2-ethylphenyl)-3-[[4-(1-piperidylmethyl)phenyl]methyl]thiourea CAS Name: 1-(2-ethylphenyl)-3-[[4-(1-piperidinylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(2-ethylphenyl)-3-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(2-ethylphenyl)-3-[4-(piperidinomethyl)benzyl]thiourea Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NCC2=CC=C(C=C2)CN3CCCCC3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NCC2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C22H29N3S/c1-2-20-8-4-5-9-21(20)24-22(26)23-16-18-10-12-19(13-11-18)17-25-14-6-3-7-15-25/h4-5,8-13H,2-3,6-7,14-17H2,1H3,(H2,23,24,26)