N-[3-[1-[(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)carbamoylamino]ethyl]phenyl]ethanamide

Systemtic Name: N-[3-[1-[(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)carbamoylamino]ethyl]phenyl]ethanamide Openeye Name: N-[3-[1-[(6-fluorothiochroman-4-yl)carbamoylamino]ethyl]phenyl]acetamide CAS Name: N-[3-[1-[[[(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]-oxomethyl]amino]ethyl]phenyl]acetamide IUPAC Name: N-[3-[1-[(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)carbamoylamino]ethyl]phenyl]acetamide Traditional Name: N-[3-[1-[(6-fluorothiochroman-4-yl)carbamoylamino]ethyl]phenyl]acetamide Formula: C20H22FN3O2S MolecularWeight: 387.470983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)NC2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C20H22FN3O2S/c1-12(14-4-3-5-16(10-14)23-13(2)25)22-20(26)24-18-8-9-27-19-7-6-15(21)11-17(18)19/h3-7,10-12,18H,8-9H2,1-2H3,(H,23,25)(H2,22,24,26)