1-[2-[4-(3-phenylpropanoyl)piperazin-1-yl]ethyl]-N-propan-2-yl-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[2-[4-(3-phenylpropanoyl)piperazin-1-yl]ethyl]-N-propan-2-yl-1,2,3-triazole-4-carboxamide Openeye Name: N-isopropyl-1-[2-[4-(3-phenylpropanoyl)piperazin-1-yl]ethyl]triazole-4-carboxamide CAS Name: 1-[2-[4-(1-oxo-3-phenylpropyl)-1-piperazinyl]ethyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: 1-[2-[4-(3-phenylpropanoyl)piperazin-1-yl]ethyl]-N-propan-2-yltriazole-4-carboxamide Traditional Name: 1-[2-(4-hydrocinnamoylpiperazino)ethyl]-N-isopropyl-triazole-4-carboxamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(N=N1)CCN2CCN(CC2)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)C1=CN(N=N1)CCN2CCN(CC2)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H30N6O2/c1-17(2)22-21(29)19-16-27(24-23-19)15-12-25-10-13-26(14-11-25)20(28)9-8-18-6-4-3-5-7-18/h3-7,16-17H,8-15H2,1-2H3,(H,22,29)