2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)sulfanyl]butanediamide

Systemtic Name: 2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)sulfanyl]butanediamide Openeye Name: 2-[(4-isopropyl-1,3-benzothiazol-2-yl)sulfanyl]butanediamide CAS Name: 2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)thio]butanediamide IUPAC Name: 2-[(4-propan-2-yl-1,3-benzothiazol-2-yl)sulfanyl]butanediamide Traditional Name: 2-[(4-isopropyl-1,3-benzothiazol-2-yl)thio]succinamide Formula: C14H17N3O2S2 MolecularWeight: 323.43368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)SC(CC(=O)N)C(=O)N

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)SC(CC(=O)N)C(=O)N

InChI

InChI=1S/C14H17N3O2S2/c1-7(2)8-4-3-5-9-12(8)17-14(20-9)21-10(13(16)19)6-11(15)18/h3-5,7,10H,6H2,1-2H3,(H2,15,18)(H2,16,19)