5-cyclopropyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: 5-cyclopropyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-phenyl-pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-2-phenyl-N-[(4S)-thiochroman-4-yl]pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-phenylpyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-2-phenyl-N-[(4S)-thiochroman-4-yl]pyrazole-3-carboxamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)NC3CCSC4=CC=CC=C34)C5=CC=CC=C5

Isomeric SMILES

C1CSC2=CC=CC=C2[C@H]1NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C22H21N3OS/c26-22(23-18-12-13-27-21-9-5-4-8-17(18)21)20-14-19(15-10-11-15)24-25(20)16-6-2-1-3-7-16/h1-9,14-15,18H,10-13H2,(H,23,26)/t18-/m0/s1