N-(2-azanyl-2-azanylidene-1-piperidin-3-yl-ethyl)-2-[4-cyclopropyl-1-naphthalen-2-ylsulfonyl-3,6-bis(oxidanylidene)piperazin-2-yl]ethanamide hydrochloride

Systemtic Name: N-(2-azanyl-2-azanylidene-1-piperidin-3-yl-ethyl)-2-[4-cyclopropyl-1-naphthalen-2-ylsulfonyl-3,6-bis(oxidanylidene)piperazin-2-yl]ethanamide hydrochloride Openeye Name: N-[2-amino-2-imino-1-(3-piperidyl)ethyl]-2-[4-cyclopropyl-1-(2-naphthylsulfonyl)-3,6-dioxo-piperazin-2-yl]acetamide hydrochloride CAS Name: N-[2-amino-2-imino-1-(3-piperidinyl)ethyl]-2-[4-cyclopropyl-1-(2-naphthalenylsulfonyl)-3,6-dioxo-2-piperazinyl]acetamide hydrochloride IUPAC Name: N-(2-amino-2-imino-1-piperidin-3-ylethyl)-2-(4-cyclopropyl-1-naphthalen-2-ylsulfonyl-3,6-dioxopiperazin-2-yl)acetamide hydrochloride Traditional Name: N-[2-amino-2-imino-1-(3-piperidyl)ethyl]-2-[4-cyclopropyl-3,6-diketo-1-(2-naphthylsulfonyl)piperazin-2-yl]acetamide hydrochloride Formula: C26H33ClN6O5S MolecularWeight: 577.09542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(C(=N)N)NC(=O)CC2C(=O)N(CC(=O)N2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5CC5.Cl

Isomeric SMILES

C1CC(CNC1)C(C(=N)N)NC(=O)CC2C(=O)N(CC(=O)N2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5CC5.Cl

InChI

InChI=1S/C26H32N6O5S.ClH/c27-25(28)24(18-6-3-11-29-14-18)30-22(33)13-21-26(35)31(19-8-9-19)15-23(34)32(21)38(36,37)20-10-7-16-4-1-2-5-17(16)12-20;/h1-2,4-5,7,10,12,18-19,21,24,29H,3,6,8-9,11,13-15H2,(H3,27,28)(H,30,33);1H