N-[1-oxidanylidene-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-oxidanylidene-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-benzyl-2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]thiophene-2-carboxamide CAS Name: N-[1-oxo-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-oxo-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-benzyl-2-keto-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]thiophene-2-carboxamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H21N3O2S2/c25-19(24-21-23-15-9-4-5-10-17(15)28-21)16(13-14-7-2-1-3-8-14)22-20(26)18-11-6-12-27-18/h1-3,6-8,11-12,16H,4-5,9-10,13H2,(H,22,26)(H,23,24,25)