N-[(E)-3-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]amino]-1-(furan-2-yl)-3-oxidanylidene-prop-1-en-2-yl]-4-tert-butyl-benzamide

Systemtic Name: N-[(E)-3-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]amino]-1-(furan-2-yl)-3-oxidanylidene-prop-1-en-2-yl]-4-tert-butyl-benzamide Openeye Name: 4-tert-butyl-N-[(E)-2-(2-furyl)-1-[(4-guanidinosulfonylphenyl)carbamoyl]vinyl]benzamide CAS Name: 4-tert-butyl-N-[(E)-3-[4-(diaminomethylideneamino)sulfonylanilino]-1-(2-furanyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[(E)-3-[4-(diaminomethylideneamino)sulfonylanilino]-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[(E)-2-(2-furyl)-1-[(4-guanidinosulfonylphenyl)carbamoyl]vinyl]benzamide Formula: C25H27N5O5S MolecularWeight: 509.57738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC=CO2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N=C(N)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CO2)/C(=O)NC3=CC=C(C=C3)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C25H27N5O5S/c1-25(2,3)17-8-6-16(7-9-17)22(31)29-21(15-19-5-4-14-35-19)23(32)28-18-10-12-20(13-11-18)36(33,34)30-24(26)27/h4-15H,1-3H3,(H,28,32)(H,29,31)(H4,26,27,30)/b21-15+