N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-chloranyl-3-nitro-benzohydrazide

Systemtic Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-chloranyl-3-nitro-benzohydrazide Openeye Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-chloro-3-nitro-benzohydrazide CAS Name: N'-[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]-4-chloro-3-nitrobenzohydrazide IUPAC Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-chloro-3-nitrobenzohydrazide Traditional Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-chloro-3-nitro-benzohydrazide Formula: C18H15ClN4O4S MolecularWeight: 418.8541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O4S/c19-12-9-8-11(10-14(12)23(26)27)18(25)22-21-16(24)6-3-7-17-20-13-4-1-2-5-15(13)28-17/h1-2,4-5,8-10H,3,6-7H2,(H,21,24)(H,22,25)