2-(2H-benzotriazol-5-ylcarbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide

Systemtic Name: 2-(2H-benzotriazol-5-ylcarbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Openeye Name: 2-(2H-benzotriazole-5-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide CAS Name: 2-[2H-benzotriazol-5-yl(oxo)methyl]-N-[2-(1-cyclohexenyl)ethyl]-1-pyrazolidinecarbothioamide IUPAC Name: 2-(2H-benzotriazole-5-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Traditional Name: 2-(2H-benzotriazole-5-carbonyl)-N-[2-(cyclohexen-1-yl)ethyl]pyrazolidine-1-carbothioamide Formula: C19H24N6OS MolecularWeight: 384.49846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C19H24N6OS/c26-18(15-7-8-16-17(13-15)22-23-21-16)24-11-4-12-25(24)19(27)20-10-9-14-5-2-1-3-6-14/h5,7-8,13H,1-4,6,9-12H2,(H,20,27)(H,21,22,23)