1-[4-(1-azanylethylideneamino)cyclohexyl]carbonyl-4-(6-chloranylnaphthalen-2-yl)sulfonyl-piperazine-2-carboxylic acid

Systemtic Name: 1-[4-(1-azanylethylideneamino)cyclohexyl]carbonyl-4-(6-chloranylnaphthalen-2-yl)sulfonyl-piperazine-2-carboxylic acid Openeye Name: 1-[4-(1-aminoethylideneamino)cyclohexanecarbonyl]-4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-2-carboxylic acid CAS Name: 1-[[4-(1-aminoethylideneamino)cyclohexyl]-oxomethyl]-4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-piperazinecarboxylic acid IUPAC Name: 1-[4-(1-aminoethylideneamino)cyclohexanecarbonyl]-4-(6-chloronaphthalen-2-yl)sulfonylpiperazine-2-carboxylic acid Traditional Name: 1-[4-(1-aminoethylideneamino)cyclohexanecarbonyl]-4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-2-carboxylic acid Formula: C24H29ClN4O5S MolecularWeight: 521.02886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1CCC(CC1)C(=O)N2CCN(CC2C(=O)O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)N

Isomeric SMILES

CC(=NC1CCC(CC1)C(=O)N2CCN(CC2C(=O)O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)N

InChI

InChI=1S/C24H29ClN4O5S/c1-15(26)27-20-7-3-16(4-8-20)23(30)29-11-10-28(14-22(29)24(31)32)35(33,34)21-9-5-17-12-19(25)6-2-18(17)13-21/h2,5-6,9,12-13,16,20,22H,3-4,7-8,10-11,14H2,1H3,(H2,26,27)(H,31,32)