2-[6-(2-azanyl-2-oxidanylidene-ethyl)-4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(4-pyridin-4-ylphenyl)carbonyl-piperazin-2-yl]ethanamide

Systemtic Name: 2-[6-(2-azanyl-2-oxidanylidene-ethyl)-4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(4-pyridin-4-ylphenyl)carbonyl-piperazin-2-yl]ethanamide Openeye Name: 2-[6-(2-amino-2-oxo-ethyl)-4-[(6-chloro-2-naphthyl)sulfonyl]-1-[4-(4-pyridyl)benzoyl]piperazin-2-yl]acetamide CAS Name: 2-[6-(2-amino-2-oxoethyl)-4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[oxo-(4-pyridin-4-ylphenyl)methyl]-2-piperazinyl]acetamide IUPAC Name: 2-[6-(2-amino-2-oxoethyl)-4-(6-chloronaphthalen-2-yl)sulfonyl-1-(4-pyridin-4-ylbenzoyl)piperazin-2-yl]acetamide Traditional Name: 2-[6-(2-amino-2-keto-ethyl)-4-[(6-chloro-2-naphthyl)sulfonyl]-1-[4-(4-pyridyl)benzoyl]piperazin-2-yl]acetamide Formula: C30H28ClN5O5S MolecularWeight: 606.09182

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC(=O)N)C(=O)C4=CC=C(C=C4)C5=CC=NC=C5)CC(=O)N

Isomeric SMILES

C1C(N(C(CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC(=O)N)C(=O)C4=CC=C(C=C4)C5=CC=NC=C5)CC(=O)N

InChI

InChI=1S/C30H28ClN5O5S/c31-24-7-5-23-14-27(8-6-22(23)13-24)42(40,41)35-17-25(15-28(32)37)36(26(18-35)16-29(33)38)30(39)21-3-1-19(2-4-21)20-9-11-34-12-10-20/h1-14,25-26H,15-18H2,(H2,32,37)(H2,33,38)