[2-[3-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-3,3-dimethyl-piperazin-1-yl]pyridin-2-yl]cyclohexa-2,4-dien-1-ylidene]methanone

Systemtic Name: [2-[3-[2-(6-chloranylnaphthalen-2-yl)sulfonyl-3,3-dimethyl-piperazin-1-yl]pyridin-2-yl]cyclohexa-2,4-dien-1-ylidene]methanone Openeye Name: [2-[3-[2-[(6-chloro-2-naphthyl)sulfonyl]-3,3-dimethyl-piperazin-1-yl]-2-pyridyl]cyclohexa-2,4-dien-1-ylidene]methanone CAS Name: [2-[3-[2-[(6-chloro-2-naphthalenyl)sulfonyl]-3,3-dimethyl-1-piperazinyl]-2-pyridinyl]-1-cyclohexa-2,4-dienylidene]methanone IUPAC Name: [2-[3-[2-(6-chloronaphthalen-2-yl)sulfonyl-3,3-dimethylpiperazin-1-yl]pyridin-2-yl]cyclohexa-2,4-dien-1-ylidene]methanone Traditional Name: [2-[3-[2-[(6-chloro-2-naphthyl)sulfonyl]-3,3-dimethyl-piperazino]-2-pyridyl]cyclohexa-2,4-dien-1-ylidene]methanone Formula: C28H26ClN3O3S MolecularWeight: 520.04234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCN1)C2=C(N=CC=C2)C3=CC=CCC3=C=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C

Isomeric SMILES

CC1(C(N(CCN1)C2=C(N=CC=C2)C3=CC=CCC3=C=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C

InChI

InChI=1S/C28H26ClN3O3S/c1-28(2)27(36(34,35)23-12-10-19-16-22(29)11-9-20(19)17-23)32(15-14-31-28)25-8-5-13-30-26(25)24-7-4-3-6-21(24)18-33/h3-5,7-13,16-17,27,31H,6,14-15H2,1-2H3