methyl 4-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-1-[(3-methyl-2-methylimino-1,3-thiazol-4-yl)methyl]piperazine-2-carboxylate

Systemtic Name: methyl 4-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-1-[(3-methyl-2-methylimino-1,3-thiazol-4-yl)methyl]piperazine-2-carboxylate Openeye Name: methyl 4-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-1-[(3-methyl-2-methylimino-thiazol-4-yl)methyl]piperazine-2-carboxylate CAS Name: 4-[3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-oxopropyl]-1-[(3-methyl-2-methylimino-4-thiazolyl)methyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-(6-chloronaphthalen-2-yl)sulfonylpropanoyl]-1-[(3-methyl-2-methylimino-1,3-thiazol-4-yl)methyl]piperazine-2-carboxylate Traditional Name: 4-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-1-[(3-methyl-2-methylimino-4-thiazolin-4-yl)methyl]piperazine-2-carboxylic acid methyl ester Formula: C25H29ClN4O5S2 MolecularWeight: 565.10456

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C(=CS1)CN2CCN(CC2C(=O)OC)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C

Isomeric SMILES

CN=C1N(C(=CS1)CN2CCN(CC2C(=O)OC)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C

InChI

InChI=1S/C25H29ClN4O5S2/c1-27-25-28(2)20(16-36-25)14-29-9-10-30(15-22(29)24(32)35-3)23(31)8-11-37(33,34)21-7-5-17-12-19(26)6-4-18(17)13-21/h4-7,12-13,16,22H,8-11,14-15H2,1-3H3