N-(1,3-benzothiazol-2-yl)-2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-cyclopentyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1,3-benzothiazol-2-yl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[(5-cyclopentyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-cyclopentyl-1,2,4-triazol-3-yl)thio]-N-(1,3-benzothiazol-2-yl)acetamide Formula: C19H21N5OS2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)C4CCCC4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)C4CCCC4

InChI

InChI=1S/C19H21N5OS2/c1-2-11-24-17(13-7-3-4-8-13)22-23-19(24)26-12-16(25)21-18-20-14-9-5-6-10-15(14)27-18/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2,(H,20,21,25)