(4S)-N-(2-chloranyl-5-nitro-phenyl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioamide

Systemtic Name: (4S)-N-(2-chloranyl-5-nitro-phenyl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioamide Openeye Name: (4S)-N-(2-chloro-5-nitro-phenyl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioamide CAS Name: (4S)-N-(2-chloro-5-nitrophenyl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioamide IUPAC Name: (4S)-N-(2-chloro-5-nitrophenyl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioamide Traditional Name: (4S)-N-(2-chloro-5-nitro-phenyl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbothioamide Formula: C16H16ClN3O2S2 MolecularWeight: 381.90014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)SC=C2

Isomeric SMILES

CC[C@H]1C2=C(CCN1C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)SC=C2

InChI

InChI=1S/C16H16ClN3O2S2/c1-2-14-11-6-8-24-15(11)5-7-19(14)16(23)18-13-9-10(20(21)22)3-4-12(13)17/h3-4,6,8-9,14H,2,5,7H2,1H3,(H,18,23)/t14-/m0/s1