N1-[1-(1,3-benzothiazol-2-yl)-5-(diazanylmethylideneamino)-1-oxidanylidene-pentan-2-yl]pyrrolidine-1,2-dicarboxamide

Systemtic Name: N1-[1-(1,3-benzothiazol-2-yl)-5-(diazanylmethylideneamino)-1-oxidanylidene-pentan-2-yl]pyrrolidine-1,2-dicarboxamide Openeye Name: N1-[1-(1,3-benzothiazole-2-carbonyl)-4-(hydrazinomethyleneamino)butyl]pyrrolidine-1,2-dicarboxamide CAS Name: N1-[1-(1,3-benzothiazol-2-yl)-5-(hydrazinylmethylideneamino)-1-oxopentan-2-yl]pyrrolidine-1,2-dicarboxamide IUPAC Name: 1-N-[1-(1,3-benzothiazol-2-yl)-5-(hydrazinylmethylideneamino)-1-oxopentan-2-yl]pyrrolidine-1,2-dicarboxamide Traditional Name: N-[1-(1,3-benzothiazole-2-carbonyl)-4-(hydrazinomethyleneamino)butyl]pyrrolidine-1,2-dicarboxamide Formula: C19H25N7O3S MolecularWeight: 431.5119

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC(CCCN=CNN)C(=O)C2=NC3=CC=CC=C3S2)C(=O)N

Isomeric SMILES

C1CC(N(C1)C(=O)NC(CCCN=CNN)C(=O)C2=NC3=CC=CC=C3S2)C(=O)N

InChI

InChI=1S/C19H25N7O3S/c20-17(28)14-7-4-10-26(14)19(29)25-13(6-3-9-22-11-23-21)16(27)18-24-12-5-1-2-8-15(12)30-18/h1-2,5,8,11,13-14H,3-4,6-7,9-10,21H2,(H2,20,28)(H,22,23)(H,25,29)