ethyl N-[4-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]-1-pyridin-4-yl-piperidin-4-yl]carbamate

Systemtic Name: ethyl N-[4-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]-1-pyridin-4-yl-piperidin-4-yl]carbamate Openeye Name: ethyl N-[4-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]methyl]-1-(4-pyridyl)-4-piperidyl]carbamate CAS Name: N-[4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]methyl]-1-pyridin-4-yl-4-piperidinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]methyl]-1-pyridin-4-ylpiperidin-4-yl]carbamate Traditional Name: N-[4-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]methyl]-1-(4-pyridyl)-4-piperidyl]carbamic acid ethyl ester Formula: C28H32ClN5O5S MolecularWeight: 586.10218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1(CCN(CC1)C2=CC=NC=C2)CN3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CCOC(=O)NC1(CCN(CC1)C2=CC=NC=C2)CN3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C28H32ClN5O5S/c1-2-39-27(36)31-28(9-13-32(14-10-28)24-7-11-30-12-8-24)20-33-15-16-34(19-26(33)35)40(37,38)25-6-4-21-17-23(29)5-3-22(21)18-25/h3-8,11-12,17-18H,2,9-10,13-16,19-20H2,1H3,(H,31,36)