4-azanyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,2-thiazole-3-carboxamide

Systemtic Name: 4-azanyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,2-thiazole-3-carboxamide Openeye Name: 4-amino-5-(4-benzylpiperazine-1-carbonyl)isothiazole-3-carboxamide CAS Name: 4-amino-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-3-isothiazolecarboxamide IUPAC Name: 4-amino-5-(4-benzylpiperazine-1-carbonyl)-1,2-thiazole-3-carboxamide Traditional Name: 4-amino-5-(4-benzylpiperazine-1-carbonyl)isothiazole-3-carboxamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C16H19N5O2S/c17-12-13(15(18)22)19-24-14(12)16(23)21-8-6-20(7-9-21)10-11-4-2-1-3-5-11/h1-5H,6-10,17H2,(H2,18,22)