N-propan-2-yl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-propan-2-yl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-acetamide CAS Name: N-propan-2-yl-2-[[4-prop-2-enyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-propan-2-yl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]thio]-N-isopropyl-acetamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=CC3=C(C=C2)N=CC=C3

Isomeric SMILES

CC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=CC3=C(C=C2)N=CC=C3

InChI

InChI=1S/C19H21N5OS/c1-4-10-24-18(15-7-8-16-14(11-15)6-5-9-20-16)22-23-19(24)26-12-17(25)21-13(2)3/h4-9,11,13H,1,10,12H2,2-3H3,(H,21,25)