(1-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)-(4-propan-2-ylpiperazin-1-yl)methanone

Systemtic Name: (1-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)-(4-propan-2-ylpiperazin-1-yl)methanone Openeye Name: (4-isopropylpiperazin-1-yl)-[1-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]methanone CAS Name: (1-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)-(4-propan-2-yl-1-piperazinyl)methanone IUPAC Name: (1-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)-(4-propan-2-ylpiperazin-1-yl)methanone Traditional Name: (4-isopropylpiperazino)-[1-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]methanone Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H23N5OS/c1-15(2)23-10-12-24(13-11-23)20(26)18-21-19(17-9-6-14-27-17)25(22-18)16-7-4-3-5-8-16/h3-9,14-15H,10-13H2,1-2H3