5-[bis(azanyl)methylideneamino]-2-[(4-but-2-ynoxyphenyl)sulfonylamino]-N-oxidanyl-pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[(4-but-2-ynoxyphenyl)sulfonylamino]-N-oxidanyl-pentanamide Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-guanidino-pentanehydroxamic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(diaminomethylideneamino)-N-hydroxypentanamide IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(diaminomethylideneamino)-N-hydroxypentanamide Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-guanidino-pentanehydroxamic acid Formula: C16H23N5O5S MolecularWeight: 397.44932

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(N)N)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(N)N)C(=O)NO

InChI

InChI=1S/C16H23N5O5S/c1-2-3-11-26-12-6-8-13(9-7-12)27(24,25)21-14(15(22)20-23)5-4-10-19-16(17)18/h6-9,14,21,23H,4-5,10-11H2,1H3,(H,20,22)(H4,17,18,19)