N'-[1-(1,3-benzothiazol-2-yl)-5-(diazanylmethylideneamino)-1-oxidanylidene-pentan-2-yl]butanediamide

Systemtic Name: N'-[1-(1,3-benzothiazol-2-yl)-5-(diazanylmethylideneamino)-1-oxidanylidene-pentan-2-yl]butanediamide Openeye Name: N'-[1-(1,3-benzothiazole-2-carbonyl)-4-(hydrazinomethyleneamino)butyl]butanediamide CAS Name: N'-[1-(1,3-benzothiazol-2-yl)-5-(hydrazinylmethylideneamino)-1-oxopentan-2-yl]butanediamide IUPAC Name: N'-[1-(1,3-benzothiazol-2-yl)-5-(hydrazinylmethylideneamino)-1-oxopentan-2-yl]butanediamide Traditional Name: N'-[1-(1,3-benzothiazole-2-carbonyl)-4-(hydrazinomethyleneamino)butyl]succinamide Formula: C17H22N6O3S MolecularWeight: 390.45998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=O)C(CCCN=CNN)NC(=O)CCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=O)C(CCCN=CNN)NC(=O)CCC(=O)N

InChI

InChI=1S/C17H22N6O3S/c18-14(24)7-8-15(25)22-12(5-3-9-20-10-21-19)16(26)17-23-11-4-1-2-6-13(11)27-17/h1-2,4,6,10,12H,3,5,7-9,19H2,(H2,18,24)(H,20,21)(H,22,25)