N-[6-azanyl-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-hexan-2-yl]-4-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[6-azanyl-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-hexan-2-yl]-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-amino-1-(1,3-benzothiazole-2-carbonyl)pentyl]-4-hydroxy-pyrrolidine-2-carboxamide CAS Name: N-[6-amino-1-(1,3-benzothiazol-2-yl)-1-oxohexan-2-yl]-4-hydroxy-2-pyrrolidinecarboxamide IUPAC Name: N-[6-amino-1-(1,3-benzothiazol-2-yl)-1-oxohexan-2-yl]-4-hydroxypyrrolidine-2-carboxamide Traditional Name: N-[5-amino-1-(1,3-benzothiazole-2-carbonyl)pentyl]-4-hydroxy-pyrrolidine-2-carboxamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)NC(CCCCN)C(=O)C2=NC3=CC=CC=C3S2)O

Isomeric SMILES

C1C(CNC1C(=O)NC(CCCCN)C(=O)C2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C18H24N4O3S/c19-8-4-3-6-13(21-17(25)14-9-11(23)10-20-14)16(24)18-22-12-5-1-2-7-15(12)26-18/h1-2,5,7,11,13-14,20,23H,3-4,6,8-10,19H2,(H,21,25)