(E)-3-(3-methoxyphenyl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-methoxyphenyl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-methoxyphenyl)-2-[4-(2-naphthylsulfonyl)piperazine-1-carbonyl]prop-2-enenitrile CAS Name: (E)-3-(3-methoxyphenyl)-2-[[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-methoxyphenyl)-2-(4-naphthalen-2-ylsulfonylpiperazine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-methoxyphenyl)-2-[4-(2-naphthylsulfonyl)piperazine-1-carbonyl]acrylonitrile Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C#N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(\C#N)/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H23N3O4S/c1-32-23-8-4-5-19(16-23)15-22(18-26)25(29)27-11-13-28(14-12-27)33(30,31)24-10-9-20-6-2-3-7-21(20)17-24/h2-10,15-17H,11-14H2,1H3/b22-15+