(5-azanyl-3-piperidin-1-yl-1,2,4-triazol-1-yl)-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: (5-azanyl-3-piperidin-1-yl-1,2,4-triazol-1-yl)-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [5-amino-3-(1-piperidyl)-1,2,4-triazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [5-amino-3-(1-piperidinyl)-1,2,4-triazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: (5-amino-3-piperidin-1-yl-1,2,4-triazol-1-yl)-(3,4,5-trimethoxyphenyl)methanone Traditional Name: (5-amino-3-piperidino-1,2,4-triazol-1-yl)-(3,4,5-trimethoxyphenyl)methanone Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2C(=NC(=N2)N3CCCCC3)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2C(=NC(=N2)N3CCCCC3)N

InChI

InChI=1S/C17H23N5O4/c1-24-12-9-11(10-13(25-2)14(12)26-3)15(23)22-16(18)19-17(20-22)21-7-5-4-6-8-21/h9-10H,4-8H2,1-3H3,(H2,18,19,20)