2-[(5-aminocarbonyl-1,3-benzothiazol-2-yl)sulfanyl]-N,N'-diethyl-butanediamide

Systemtic Name: 2-[(5-aminocarbonyl-1,3-benzothiazol-2-yl)sulfanyl]-N,N'-diethyl-butanediamide Openeye Name: 2-[(5-carbamoyl-1,3-benzothiazol-2-yl)sulfanyl]-N,N'-diethyl-butanediamide CAS Name: 2-[(5-carbamoyl-1,3-benzothiazol-2-yl)thio]-N,N'-diethylbutanediamide IUPAC Name: 2-[(5-carbamoyl-1,3-benzothiazol-2-yl)sulfanyl]-N,N'-diethylbutanediamide Traditional Name: 2-[(5-carbamoyl-1,3-benzothiazol-2-yl)thio]-N,N'-diethyl-succinamide Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CC(C(=O)NCC)SC1=NC2=C(S1)C=CC(=C2)C(=O)N

Isomeric SMILES

CCNC(=O)CC(C(=O)NCC)SC1=NC2=C(S1)C=CC(=C2)C(=O)N

InChI

InChI=1S/C16H20N4O3S2/c1-3-18-13(21)8-12(15(23)19-4-2)25-16-20-10-7-9(14(17)22)5-6-11(10)24-16/h5-7,12H,3-4,8H2,1-2H3,(H2,17,22)(H,18,21)(H,19,23)