1-[4-[(3-butyl-2-butylimino-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-3-(6-chloranylnaphthalen-2-yl)sulfonyl-propan-1-one

Systemtic Name: 1-[4-[(3-butyl-2-butylimino-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-3-(6-chloranylnaphthalen-2-yl)sulfonyl-propan-1-one Openeye Name: 1-[4-[(3-butyl-2-butylimino-thiazol-4-yl)methyl]piperazin-1-yl]-3-[(6-chloro-2-naphthyl)sulfonyl]propan-1-one CAS Name: 1-[4-[(3-butyl-2-butylimino-4-thiazolyl)methyl]-1-piperazinyl]-3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-propanone IUPAC Name: 1-[4-[(3-butyl-2-butylimino-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-3-(6-chloronaphthalen-2-yl)sulfonylpropan-1-one Traditional Name: 1-[4-[(3-butyl-2-butylimino-4-thiazolin-4-yl)methyl]piperazino]-3-[(6-chloro-2-naphthyl)sulfonyl]propan-1-one Formula: C29H39ClN4O3S2 MolecularWeight: 591.22796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C1N(C(=CS1)CN2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)CCCC

Isomeric SMILES

CCCCN=C1N(C(=CS1)CN2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)CCCC

InChI

InChI=1S/C29H39ClN4O3S2/c1-3-5-12-31-29-34(13-6-4-2)26(22-38-29)21-32-14-16-33(17-15-32)28(35)11-18-39(36,37)27-10-8-23-19-25(30)9-7-24(23)20-27/h7-10,19-20,22H,3-6,11-18,21H2,1-2H3