1-(naphthalen-1-ylmethyl)-3-phenethyl-1-(2-piperidin-1-ylethyl)thiourea

Systemtic Name: 1-(naphthalen-1-ylmethyl)-3-phenethyl-1-(2-piperidin-1-ylethyl)thiourea Openeye Name: 1-(1-naphthylmethyl)-3-phenethyl-1-[2-(1-piperidyl)ethyl]thiourea CAS Name: 1-(1-naphthalenylmethyl)-3-phenethyl-1-[2-(1-piperidinyl)ethyl]thiourea IUPAC Name: 1-(naphthalen-1-ylmethyl)-3-phenethyl-1-(2-piperidin-1-ylethyl)thiourea Traditional Name: 1-(1-naphthylmethyl)-3-phenethyl-1-(2-piperidinoethyl)thiourea Formula: C27H33N3S MolecularWeight: 431.63602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN(CC2=CC=CC3=CC=CC=C32)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCN(CC2=CC=CC3=CC=CC=C32)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H33N3S/c31-27(28-17-16-23-10-3-1-4-11-23)30(21-20-29-18-7-2-8-19-29)22-25-14-9-13-24-12-5-6-15-26(24)25/h1,3-6,9-15H,2,7-8,16-22H2,(H,28,31)