N-phenyl-1-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide

Systemtic Name: N-phenyl-1-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide Openeye Name: 1-[(4-isopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-N-phenyl-piperidine-3-carboxamide CAS Name: N-phenyl-1-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-phenyl-1-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperidine-3-carboxamide Traditional Name: 1-[(4-isopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-N-phenyl-nipecotamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN(C1=S)CN2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C=NN(C1=S)CN2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H25N5OS/c1-14(2)22-12-19-23(18(22)25)13-21-10-6-7-15(11-21)17(24)20-16-8-4-3-5-9-16/h3-5,8-9,12,14-15H,6-7,10-11,13H2,1-2H3,(H,20,24)