N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-methyl-1-(2-methylpropyl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-methyl-1-(2-methylpropyl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-isobutyl-3-methyl-N-[(4S)-thiochroman-4-yl]thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-methyl-1-(2-methylpropyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-methyl-1-(2-methylpropyl)thieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-isobutyl-3-methyl-N-[(4S)-thiochroman-4-yl]thieno[2,3-c]pyrazole-5-carboxamide Formula: C20H23N3OS2 MolecularWeight: 385.54612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3CCSC4=CC=CC=C34)CC(C)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N[C@H]3CCSC4=CC=CC=C34)CC(C)C

InChI

InChI=1S/C20H23N3OS2/c1-12(2)11-23-20-15(13(3)22-23)10-18(26-20)19(24)21-16-8-9-25-17-7-5-4-6-14(16)17/h4-7,10,12,16H,8-9,11H2,1-3H3,(H,21,24)/t16-/m0/s1