N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[(4S)-thiochroman-4-yl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[(4S)-thiochroman-4-yl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1CSC2=CC=CC=C2[C@H]1NC(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C18H16N4OS/c23-18(13-5-7-14(8-6-13)22-12-19-11-20-22)21-16-9-10-24-17-4-2-1-3-15(16)17/h1-8,11-12,16H,9-10H2,(H,21,23)/t16-/m0/s1