1-[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]-4-methyl-2-(10H-phenoxazin-2-ylsulfonyl)piperidine-2-carboxylic acid

Systemtic Name: 1-[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]-4-methyl-2-(10H-phenoxazin-2-ylsulfonyl)piperidine-2-carboxylic acid Openeye Name: 1-(2-amino-5-guanidino-pentanoyl)-4-methyl-2-(10H-phenoxazin-2-ylsulfonyl)piperidine-2-carboxylic acid CAS Name: 1-[2-amino-5-(diaminomethylideneamino)-1-oxopentyl]-4-methyl-2-(10H-phenoxazin-2-ylsulfonyl)-2-piperidinecarboxylic acid IUPAC Name: 1-[2-amino-5-(diaminomethylideneamino)pentanoyl]-4-methyl-2-(10H-phenoxazin-2-ylsulfonyl)piperidine-2-carboxylic acid Traditional Name: 1-(2-amino-5-guanidino-pentanoyl)-4-methyl-2-(10H-phenoxazin-2-ylsulfonyl)pipecolinic acid Formula: C25H32N6O6S MolecularWeight: 544.62318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C(C1)(C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C4N3)C(=O)C(CCCN=C(N)N)N

Isomeric SMILES

CC1CCN(C(C1)(C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C4N3)C(=O)C(CCCN=C(N)N)N

InChI

InChI=1S/C25H32N6O6S/c1-15-10-12-31(22(32)17(26)5-4-11-29-24(27)28)25(14-15,23(33)34)38(35,36)16-8-9-21-19(13-16)30-18-6-2-3-7-20(18)37-21/h2-3,6-9,13,15,17,30H,4-5,10-12,14,26H2,1H3,(H,33,34)(H4,27,28,29)