N-cyclopropyl-4-(2-phenoxyethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-(2-phenoxyethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-cyclopropyl-4-(2-phenoxyethyl)piperazin-4-ium-1-carbothioamide CAS Name: N-cyclopropyl-4-(2-phenoxyethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-cyclopropyl-4-(2-phenoxyethyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-cyclopropyl-4-(2-phenoxyethyl)piperazin-4-ium-1-carbothioamide Formula: C16H24N3OS+ MolecularWeight: 306.44626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

C1CC1NC(=S)N2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C16H23N3OS/c21-16(17-14-6-7-14)19-10-8-18(9-11-19)12-13-20-15-4-2-1-3-5-15/h1-5,14H,6-13H2,(H,17,21)/p+1