1-(phenylmethyl)-3-(3-piperidin-1-yl-1H-1,2,4-triazol-5-yl)thiourea

Systemtic Name: 1-(phenylmethyl)-3-(3-piperidin-1-yl-1H-1,2,4-triazol-5-yl)thiourea Openeye Name: 1-benzyl-3-[3-(1-piperidyl)-1H-1,2,4-triazol-5-yl]thiourea CAS Name: 1-(phenylmethyl)-3-[3-(1-piperidinyl)-1H-1,2,4-triazol-5-yl]thiourea IUPAC Name: 1-benzyl-3-(3-piperidin-1-yl-1H-1,2,4-triazol-5-yl)thiourea Traditional Name: 1-benzyl-3-(3-piperidino-1H-1,2,4-triazol-5-yl)thiourea Formula: C15H20N6S MolecularWeight: 316.4245

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NNC(=N2)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C2=NNC(=N2)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C15H20N6S/c22-15(16-11-12-7-3-1-4-8-12)18-13-17-14(20-19-13)21-9-5-2-6-10-21/h1,3-4,7-8H,2,5-6,9-11H2,(H3,16,17,18,19,20,22)