3-butyl-1-(1-methylpiperidin-4-yl)-1-phenethyl-thiourea

Systemtic Name: 3-butyl-1-(1-methylpiperidin-4-yl)-1-phenethyl-thiourea Openeye Name: 3-butyl-1-(1-methyl-4-piperidyl)-1-phenethyl-thiourea CAS Name: 3-butyl-1-(1-methyl-4-piperidinyl)-1-phenethylthiourea IUPAC Name: 3-butyl-1-(1-methylpiperidin-4-yl)-1-phenethylthiourea Traditional Name: 3-butyl-1-(1-methyl-4-piperidyl)-1-phenethyl-thiourea Formula: C19H31N3S MolecularWeight: 333.53454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CCC1=CC=CC=C1)C2CCN(CC2)C

Isomeric SMILES

CCCCNC(=S)N(CCC1=CC=CC=C1)C2CCN(CC2)C

InChI

InChI=1S/C19H31N3S/c1-3-4-13-20-19(23)22(18-11-14-21(2)15-12-18)16-10-17-8-6-5-7-9-17/h5-9,18H,3-4,10-16H2,1-2H3,(H,20,23)