N'-[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-5-nitro-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-5-nitro-pyrimidin-4-yl]-2-furohydrazide Formula: C17H13N7O4S MolecularWeight: 411.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)NNC(=O)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)NNC(=O)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N7O4S/c1-9-4-5-10-12(7-9)29-17(20-10)21-14-13(24(26)27)15(19-8-18-14)22-23-16(25)11-3-2-6-28-11/h2-8H,1H3,(H,23,25)(H2,18,19,20,21,22)