4-[1-(1,3-benzothiazol-2-yl)-2-(diazanylmethylideneamino)-1-oxidanylidene-pentan-2-yl]-4-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: 4-[1-(1,3-benzothiazol-2-yl)-2-(diazanylmethylideneamino)-1-oxidanylidene-pentan-2-yl]-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: 4-[1-(1,3-benzothiazole-2-carbonyl)-1-(hydrazinomethyleneamino)butyl]-4-hydroxy-pyrrolidine-2-carboxamide CAS Name: 4-[1-(1,3-benzothiazol-2-yl)-2-(hydrazinylmethylideneamino)-1-oxopentan-2-yl]-4-hydroxy-2-pyrrolidinecarboxamide IUPAC Name: 4-[1-(1,3-benzothiazol-2-yl)-2-(hydrazinylmethylideneamino)-1-oxopentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide Traditional Name: 4-[1-(1,3-benzothiazole-2-carbonyl)-1-(hydrazinomethyleneamino)butyl]-4-hydroxy-pyrrolidine-2-carboxamide Formula: C18H24N6O3S MolecularWeight: 404.48656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=NC2=CC=CC=C2S1)(C3(CC(NC3)C(=O)N)O)N=CNN

Isomeric SMILES

CCCC(C(=O)C1=NC2=CC=CC=C2S1)(C3(CC(NC3)C(=O)N)O)N=CNN

InChI

InChI=1S/C18H24N6O3S/c1-2-7-18(22-10-23-20,17(27)8-12(15(19)26)21-9-17)14(25)16-24-11-5-3-4-6-13(11)28-16/h3-6,10,12,21,27H,2,7-9,20H2,1H3,(H2,19,26)(H,22,23)