N-[bis(azanyl)methylidene]-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-[4-(2-furoyl)piperazino]-3-mesyl-benzamide Formula: C18H21N5O5S MolecularWeight: 419.45484

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)N2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C18H21N5O5S/c1-29(26,27)15-11-12(16(24)21-18(19)20)4-5-13(15)22-6-8-23(9-7-22)17(25)14-3-2-10-28-14/h2-5,10-11H,6-9H2,1H3,(H4,19,20,21,24)