N-(3,4-dihydro-2H-thiochromen-4-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-thiochroman-4-yl-triazole-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(3,4-dihydro-2H-thiochromen-4-yl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-thiochroman-4-yl-triazole-4-carboxamide Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C19H18N4OS/c24-19(20-16-10-11-25-18-9-5-4-8-15(16)18)17-13-23(22-21-17)12-14-6-2-1-3-7-14/h1-9,13,16H,10-12H2,(H,20,24)