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

Systemtic Name: N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide CAS Name: N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(4-phenylbutylamino)-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCNC2=NN=C(S2)NC(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CCCCNC2=NN=C(S2)NC(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4OS2/c26-19(18-14-16-11-4-5-12-17(16)27-18)23-21-25-24-20(28-21)22-13-7-6-10-15-8-2-1-3-9-15/h1-5,8-9,11-12,14H,6-7,10,13H2,(H,22,24)(H,23,25,26)