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

Systemtic Name: methyl N-[4-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]-pyridin-4-yl-methyl]piperidin-4-yl]carbamate Openeye Name: methyl N-[4-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]-(4-pyridyl)methyl]-4-piperidyl]carbamate CAS Name: N-[4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]-pyridin-4-ylmethyl]-4-piperidinyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]-pyridin-4-ylmethyl]piperidin-4-yl]carbamate Traditional Name: N-[4-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]-(4-pyridyl)methyl]-4-piperidyl]carbamic acid methyl ester Formula: C27H30ClN5O5S MolecularWeight: 572.0756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1(CCNCC1)C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

COC(=O)NC1(CCNCC1)C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C27H30ClN5O5S/c1-38-26(35)31-27(8-12-30-13-9-27)25(19-6-10-29-11-7-19)33-15-14-32(18-24(33)34)39(36,37)23-5-3-20-16-22(28)4-2-21(20)17-23/h2-7,10-11,16-17,25,30H,8-9,12-15,18H2,1H3,(H,31,35)