N-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-[(2-methyl-4-thiazolyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-keto-2-[4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]ethyl]thiophene-2-carboxamide Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=CS3

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C17H22N4O2S2/c1-13-19-14(12-25-13)11-20-5-3-6-21(8-7-20)16(22)10-18-17(23)15-4-2-9-24-15/h2,4,9,12H,3,5-8,10-11H2,1H3,(H,18,23)