ethyl 4-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]hydrazinylidene]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]hydrazinylidene]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]hydrazono]piperidine-1-carboxylate CAS Name: 4-[[(2S)-2-(1,3-benzothiazol-2-ylamino)-1-oxopropyl]hydrazinylidene]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]hydrazinylidene]piperidine-1-carboxylate Traditional Name: 4-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]hydrazono]piperidine-1-carboxylic acid ethyl ester Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(=NNC(=O)C(C)NC2=NC3=CC=CC=C3S2)CC1

Isomeric SMILES

CCOC(=O)N1CCC(=NNC(=O)[C@H](C)NC2=NC3=CC=CC=C3S2)CC1

InChI

InChI=1S/C18H23N5O3S/c1-3-26-18(25)23-10-8-13(9-11-23)21-22-16(24)12(2)19-17-20-14-6-4-5-7-15(14)27-17/h4-7,12H,3,8-11H2,1-2H3,(H,19,20)(H,22,24)/t12-/m0/s1