2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(1-naphthylmethyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-1-[4-(1-naphthalenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-1-[4-(1-naphthylmethyl)piperazino]ethanone Formula: C22H26N6OS MolecularWeight: 422.54644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC(=O)N3CCN(CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC(=O)N3CCN(CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C22H26N6OS/c23-28-21(17-8-9-17)24-25-22(28)30-15-20(29)27-12-10-26(11-13-27)14-18-6-3-5-16-4-1-2-7-19(16)18/h1-7,17H,8-15,23H2