N-[4-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[[4-(2-methylthiazol-4-yl)phenyl]methylamino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-(2-methyl-4-thiazolyl)phenyl]methylamino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methylamino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-[[4-(2-methylthiazol-4-yl)benzyl]amino]butyl]thiophene-2-carboxamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=O)CCCNC(=O)C3=CC=CS3

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=O)CCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C20H21N3O2S2/c1-14-23-17(13-27-14)16-8-6-15(7-9-16)12-22-19(24)5-2-10-21-20(25)18-4-3-11-26-18/h3-4,6-9,11,13H,2,5,10,12H2,1H3,(H,21,25)(H,22,24)