N-[5-[2-(1H-indol-3-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-[2-(1H-indol-3-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[5-[2-(1H-indol-3-yl)ethylamino]-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide CAS Name: N-[5-[2-(1H-indol-3-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-[2-(1H-indol-3-yl)ethylamino]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[5-[2-(1H-indol-3-yl)ethylamino]-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide Formula: C21H17N5OS2 MolecularWeight: 419.52258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C(=O)NC3=NN=C(S3)NCCC4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C(=O)NC3=NN=C(S3)NCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C21H17N5OS2/c27-19(18-11-13-5-1-4-8-17(13)28-18)24-21-26-25-20(29-21)22-10-9-14-12-23-16-7-3-2-6-15(14)16/h1-8,11-12,23H,9-10H2,(H,22,25)(H,24,26,27)