N-cyclopropyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioamide Openeye Name: 4-[(E)-cinnamyl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide CAS Name: N-cyclopropyl-4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: N-cyclopropyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbothioamide Traditional Name: 4-[(E)-cinnamyl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide Formula: C17H24N3S+ MolecularWeight: 302.45756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3S/c21-17(18-16-8-9-16)20-13-11-19(12-14-20)10-4-7-15-5-2-1-3-6-15/h1-7,16H,8-14H2,(H,18,21)/p+1/b7-4+